| SpectraBase Spectrum ID |
23yCWyVVC0E |
| Name |
Bisabolone oxide A |
| Source of Sample |
SAFC Cat.no. W227307 |
| CAS Registry Number |
58985-73-2 |
| 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 |
236.177630011 u |
| Formula |
C15H24O2 |
| InChI |
InChI=1S/C15H24O2/c1-11-5-7-12(8-6-11)15(4)10-9-13(16)14(2,3)17-15/h5,12H,6-10H2,1-4H3/t12-,15+/m1/s1 |
| InChIKey |
MJWZYBQLHJQQJJ-DOMZBBRYSA-N |
| Molecular Weight |
236.355 g/mol |
| Number of Peaks |
50 |
| RI1 |
1682 |
| RI2 |
1359 |
| SMILES |
C1(CC[C@](OC1(C)C)([C@]1(CCC(=CC1)C)[H])C)=O |
| SPLASH |
splash10-0006-9300000000-68d8dc0f665a4779c7e0 |
| 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 |
Bisabolone oxide |
| Wiley ID |
LM_FFNSC3_1120 |
