| SpectraBase Spectrum ID |
7L9RE57bNVL |
| Name |
Sclarene |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H32 |
| InChI |
InChI=1S/C20H32/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h7,17-18H,1-3,8-14H2,4-6H3/t17-,18-,20+/m0/s1 |
| InChIKey |
KYLKKZSVPLUGCC-CMKODMSKSA-N |
| Instrument Name |
Varian Saturn GC/MS 2000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np030166o |
| Molecular Weight |
272.476 g/mol |
| Optical Rotation |
[a]D24 = +45 (c = 1.0, CHCl3) |
| SMILES |
C1C[C@]2([C@](C(C1)(C)C)(CCC([C@@]2(CCC(C=C)=C)[H])=C)[H])C |
| SPLASH |
splash10-0a4i-3390000000-ffbf6c205c38cb0d4897 |
| Sample Comments |
Mixture of cis/trans |
| Source of Spectrum |
G4-66-1626-10 |
| Wiley ID |
1883925 |
