| SpectraBase Spectrum ID |
4UkEGiWVSJU |
| Name |
(-)-Isocaryophyllene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
204.187800773 u |
| Formula |
C15H24 |
| InChI |
InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/b11-6-/t13-,14-/m1/s1 |
| InChIKey |
NPNUFJAVOOONJE-FLFDDASRSA-N |
| Instrument Name |
Finnigan 9610-4021 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhrc.1240200602 |
| Molecular Weight |
204.357 g/mol |
| Quality |
218 |
| SMILES |
C\C1=C\CCC(=C)[C@]2(CC(C)(C)[C@@]2(CC1)[H])[H] |
| SPLASH |
splash10-017l-9700000000-e4d499fee07c3a9b92e8 |
| Source of Spectrum |
HRC-20-307-14 (DOI: 10.1002/jhrc.1240200602) |
| Wiley ID |
1910952 |
![CARYOPHYLLENE;(1R,9S,4E)-4,11,11-TRIMETHYL-8-METHYLIDENE-BICYCLO-[7.2.0]-UNDEC-4-ENE;CONFORMER-22A](/api/spectrum/4UkEGiWVSJU/structure.png?h=300&w=458 "CARYOPHYLLENE;(1R,9S,4E)-4,11,11-TRIMETHYL-8-METHYLIDENE-BICYCLO-[7.2.0]-UNDEC-4-ENE;CONFORMER-22A")
