| SpectraBase Spectrum ID |
9JPkWxyih1l |
| Name |
Juvibione |
| CAS Registry Number |
17904-27-7 |
| 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 |
266.188194694 u |
| Formula |
C16H26O3 |
| InChI |
InChI=1S/C16H26O3/c1-11(2)9-15(17)10-12(3)13-5-7-14(8-6-13)16(18)19-4/h7,11-13H,5-6,8-10H2,1-4H3/t12-,13?/m1/s1 |
| InChIKey |
IIWNDLDEVPJIBT-PZORYLMUSA-N |
| Molecular Weight |
266.381 g/mol |
| Number of Peaks |
50 |
| RI1 |
2016 |
| SMILES |
CC(C)CC(=O)C[C@@](C)(C1CCC(=CC1)C(=O)OC)[H] |
| SPLASH |
splash10-053r-7900000000-633f96ce5c8e8cdd47af |
| 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 |
1-Cyclohexene-1-carboxylic acid, 4-[(1R)-1,5-dimethyl-3-oxohexyl]-, methyl ester |
| Wiley ID |
LM_FFNSC3_2627 |
