| SpectraBase Spectrum ID |
CnInVfVbSXH |
| Name |
Lavandulyl acetate |
| CAS Registry Number |
69343-72-2 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
214.156894565 u |
| Formula |
C12H22O3 |
| InChI |
InChI=1S/C12H22O3/c1-9(2)6-7-11(12(4,5)14)8-15-10(3)13/h6,11,14H,7-8H2,1-5H3 |
| InChIKey |
RHNWMJNJAXBSEC-UHFFFAOYSA-N |
| Molecular Weight |
214.305 g/mol |
| Number of Peaks |
50 |
| RI1 |
1438 |
| SMILES |
OC(C)(C(COC(C)=O)CC=C(C)C)C |
| SPLASH |
splash10-000x-9100000000-c170b5b39f0dedad5694 |
| 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 |
1,3-Butanediol, 3-methyl-2-(3-methyl-2-buten-1-yl)-, 1-acetate |
| Wiley ID |
LM_FFNSC3_2973 |
