SpectraBase Spectrum ID |
4IgdVD8nNZd |
Name |
Isophyllocladene |
CAS Registry Number |
511-85-3 |
Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
Exact Mass |
272.250401030 u |
Formula |
C20H32 |
InChI |
InChI=1S/C20H32/c1-14-12-20-11-8-16-18(2,3)9-5-10-19(16,4)17(20)7-6-15(14)13-20/h12,15-17H,5-11,13H2,1-4H3 |
InChIKey |
DQUHDYWUEKWRLN-UHFFFAOYSA-N |
Molecular Weight |
272.476 g/mol |
Number of Peaks |
50 |
RI1 |
1968 |
SMILES |
CC1(CCCC2(C1CCC13C2CCC(C3)C(=C1)C)C)C |
SPLASH |
splash10-05fu-5920000000-b4a7a0442f8302d8f076 |
Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
Synonyms |
Kaur-15-ene |
Wiley ID |
LM_FFNSC3_2348 |