| SpectraBase Spectrum ID |
Kh81e6X7Joz |
| Name |
(+)-cembrene A |
| Appearance |
Colorless oil |
| Carrier Gas |
Helium |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.250401030 u |
| Formula |
C20H32 |
| InChI |
InChI=1S/C20H32/c1-16(2)20-14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,11-12,20H,1,6-7,9-10,13-15H2,2-5H3/b17-8+,18-12+,19-11+/t20-/m1/s1 |
| InChIKey |
VWSPQDDPRITBAM-UYSOGGTPSA-N |
| Inlet Type |
Splitless |
| Instrument Name |
Agilent 7890A-5975C GC |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202110842 |
| Molecular Weight |
272.476 g/mol |
| Optical Rotation |
[a]D24 = + 4.8 (c = 0.50, chloroform) |
| Quality |
1000 |
| SMILES |
C1\C=C\(CC[C@@](C\C=C\(CC\C=C\(C1)C)C)(C(=C)C)[H])C |
| SPLASH |
splash10-066u-9400000000-41f9e154bd825a054bf8 |
| Source of Spectrum |
ACI-60-SM80-7 (DOI: 10.1002/anie.202110842) |
| Wiley ID |
1896863 |
