Structure determination of trans-cinnamaldehyde by broadband microwave spectroscopy
文献情報
The rotational spectrum of trans-cinnamaldehyde ((E)-3-phenyl-2-propenal, C9H8O) was recorded by chirped-pulse Fourier transform microwave spectroscopy in the frequency range of 2–8.5 GHz. The odourant molecule is the essential component of cinnamon oil and causes the characteristic smell. The rotational signatures of two conformers were observed: s-trans–trans- and s-cis–trans-cinnamaldehyde. The rotational spectra of s-trans–trans-cinnamaldehyde and all of its 13C-monosubstituted species in natural abundance were assigned and the corresponding carbon backbone structure was determined. The second conformer s-cis–trans-cinnamaldehyde is about 9 kJ mol−1 higher in energy and could also be identified in the spectrum.
関連文献
Pure spin current and phonon thermoelectric transport in a triangulene-based molecular junction
Jianwei Li, Yihang Nie, Fuming Xu, Yunjin Yu, Bin Wang
DOI: 10.1039/C8CP02322K
Single entity electrocatalysis: oxygen reduction mediated via methyl viologen doped Nafion nanoparticles
Lifu Chen, Chuhong Lin, Richard G. Compton
DOI: 10.1039/C8CP02311E
Machine learning for predicting product distributions in catalytic regioselective reactions
Sayan Banerjee, A. Sreenithya, Raghavan B. Sunoj
DOI: 10.1039/C8CP03141J
Different scenarios of dynamic coupling in glassy colloidal mixtures
Tatjana Sentjabrskaja, José Ruiz-Franco, Stefan U. Egelhaaf
DOI: 10.1039/C8CP02559B
A vacuum ultraviolet photoionization study on the formation of methanimine (CH2NH) and ethylenediamine (NH2CH2CH2NH2) in low temperature interstellar model ices exposed to ionizing radiation
Bing-Jian Sun, Yue-Lin Chen, Agnes H. H. Chang
DOI: 10.1039/C8CP06002A
Binary mixtures of novel sulfoxides and water: intermolecular structure, dynamic properties, thermodynamics, and cluster analysis
DOI: 10.1039/C8CP04012E
Theoretical study on the optical and electronic properties of graphene quantum dots doped with heteroatoms
Jianguang Feng, Hongzhou Dong, Beili Pang, Feifei Shao, ChunKai Zhang, Liyan Yu
DOI: 10.1039/C8CP01403E
Electron correlation effects in the photoionization of CO and isoelectronic diatomic molecules
A. Ponzi, N. Quadri, C. Angeli, P. Decleva
DOI: 10.1039/C8CP06103C
Theoretical investigation of M@Pb122− and M@Sn122− Zintl clusters (M = Lrn+, Lun+, La3+, Ac3+ and n = 0, 1, 2, 3)
DOI: 10.1039/C8CP01056K
こちらもおすすめ
6-苄基-6,7-二氢-5H-吡咯并3,4-b吡啶とは何ですか?
6-苄基-6,7-二氢-5H-吡咯并3,4-b吡啶は、CAS番号109966-30-5の化合物です。これは、6-ベンジル基を持つ6,7-二氢-5H-吡咯並みの化...
半硫酸奎宁单水水合物はどのように保存すればよいですか?
半硫酸奎宁单水水合物は、乾燥した涼しい場所に保管し、直射日光や湿気を避ける必要があります。保存温度は常温(15〜25℃)が適切で、湿度は40%以下を維持すること...
D-核糖-5-リン酸二ナトリウムとは何ですか?
D-核糖-5-リン酸二ナトリウムは、CAS番号18265-46-8を有する化合物で、D-核糖の5位付加部位にリン酸基が結合した化合物です。この化合物は、水溶性で...
3-乙酰基-4-羟基喹啉-2(1H)-酮はどのように合成されますか?
3-乙酰基-4-羟基喹啉-2(1H)-酮は、ハイドロキノンと酢酸アセトイルアミドのアミド化反応により合成されます。この反応は塩基触媒を用いて行われ、選択性は良好...
5-溴-4-甲基-1H-吲唑とは何ですか?
5-溴-4-甲基-1H-吲唑は、CAS番号1082041-34-6の化学物質で、化学式はC10H9BrNです。この化合物は淡黄色の結晶性粉末で、吸湿性があります...
3-(4メトキシフェニル)オキテナン-3カーボイル酸の代替品はありますか?
3-(4メトキシフェニル)オキテナン-3カーボイル酸の代替品は、その用途により異なりますが、例えば4-(メトキシフェニル)オキテナン-3カーボイル酸や、他のオキ...
3-イリドオキシピロロ[2,3-b]ピリジン-5-カルボキシlic酸は安全ですか?
3-イリドオキシピロロ[2,3-b]ピリジン-5-カルボキシlic酸は危険な化合物ではありませんが、適切な手袋や保護眼鏡の使用を推奨します。誤って摂取または接触...
3-氟-4- iodobenolを取り扱う際の実験室安全事項は何ですか?
3-氟-4- iodobenolは可燃性を有し、強力な反応性を持つため、取り扱いには注意が必要です。PPE(個人保護具)の着用、ドラフトチャンバーの使用、漏洩時...
掲載誌
Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.










![5-Bromo-3-isopropyl-1H-pyrrolo[2,3-b]pyridine structure 5-Bromo-3-isopropyl-1H-pyrrolo[2,3-b]pyridine structure](https://static.chemtradehub.com/structs/125/1256819-54-1-8620.webp)



