| SpectraBase Spectrum ID |
L7tsbbsFiKc |
| Name |
Elema-1,3-dien-8-ol <7-acetoxy-> |
| CAS Registry Number |
394251-68-4 |
| 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 |
280.203844759 u |
| Formula |
C17H28O3 |
| InChI |
InChI=1S/C17H28O3/c1-8-16(7)9-10-17(12(4)5,20-13(6)18)15(19)14(16)11(2)3/h8,12,14-15,19H,1-2,9-10H2,3-7H3/t14-,15?,16-,17-/m1/s1 |
| InChIKey |
NJMDUVIQNSFGSC-FNAUVDMUSA-N |
| Molecular Weight |
280.408 g/mol |
| Number of Peaks |
50 |
| RI1 |
1787 |
| SMILES |
OC1[C@@](C(=C)C)([C@](C)(C=C)CC[C@]1(C(C)C)OC(=O)C)[H] |
| SPLASH |
splash10-0006-9500000000-d534216b9b462965606f |
| 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 |
1,2-Cyclohexanediol, 4-ethenyl-4-methyl-5-(1-methylethenyl)-1-(1-methylethyl)-, 1-acetate, |
| Wiley ID |
LM_FFNSC3_2863 |
