| SpectraBase Spectrum ID |
7LG2CJwMHqw |
| Name |
(3-Methylbutoxy)acetic acid 2-propenyl ester |
| CAS Registry Number |
67634-00-8 |
| Classification |
Fragrance |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
186.125594437 u |
| Formula |
C10H18O3 |
| InChI |
InChI=1S/C10H18O3/c1-4-6-13-10(11)8-12-7-5-9(2)3/h4,9H,1,5-8H2,2-3H3 |
| InChIKey |
XCWPXUNHSPOFGV-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
186.251 g/mol |
| Nominal Mass |
186 u |
| Quality |
993 |
| Retention Index |
1287 |
| SMILES |
C(COCCC(C)C)(OCC=C)=O |
| SPLASH |
splash10-0006-9100000000-a7713efbefcb6cc4231e |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
prop-2-en-1-yl (3-methylbutoxy)acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_006976 |
