| SpectraBase Spectrum ID |
7agX7hMtP2N |
| Name |
Isohibaene |
| CAS Registry Number |
5975-53-1 |
| 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/c1-17(2)8-5-9-19(4)15(17)7-11-20-13-12-18(3,14-20)10-6-16(19)20/h12-13,15-16H,5-11,14H2,1-4H3/t15?,16?,18-,19?,20+/m1/s1 |
| InChIKey |
GXMKKDDGINQVBE-YKUBFXNGSA-N |
| Molecular Weight |
272.476 g/mol |
| Number of Peaks |
50 |
| RI1 |
1937 |
| SMILES |
C1CC(C2C(C1)(C1CC[C@]3(C[C@@]1(C=C3)CC2)C)C)(C)C |
| SPLASH |
splash10-052f-8930000000-43acd4d452cf41bb78f1 |
| 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 |
17-Norkaur-15-ene, 13-methyl- |
| Wiley ID |
LM_FFNSC3_2483 |
