| SpectraBase Spectrum ID |
JVZ7z8z8g1U |
| Name |
Isocembrene [(1S,2E,7E,11E)-2,4(18),7,11-cembratetraene] |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| 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/h8,11-12,14,16,20H,4,6-7,9-10,13,15H2,1-3,5H3/b14-12+,17-8+,19-11+/t20-/m0/s1 |
| InChIKey |
VYWGLUCGRVXWKB-XJXVEZCLSA-N |
| Molecular Weight |
272.476 g/mol |
| SMILES |
C1(\C=C\[C@@](CC\C(=C\CC\C(=C\CC1)C)C)(C(C)C)[H])=C |
| SPLASH |
splash10-0a4i-0090000000-292a15dfef4a5413e7ec |
| Source of Spectrum |
Y1-44-5923-1 |
| Wiley ID |
1621590 |
![Isocembrene [(1S,2E,7E,11E)-2,4(18),7,11-cembratetraene]](/api/spectrum/JVZ7z8z8g1U/structure.png?h=300&w=458 "Isocembrene [(1S,2E,7E,11E)-2,4(18),7,11-cembratetraene]")
