| SpectraBase Spectrum ID |
8GcCRHT5yeO |
| Name |
Acetic acid methyl ester |
| CAS Registry Number |
79-20-9 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
74.036779431 u |
| Formula |
C3H6O2 |
| InChI |
InChI=1S/C3H6O2/c1-3(4)5-2/h1-2H3 |
| InChIKey |
KXKVLQRXCPHEJC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
74.079 g/mol |
| Nominal Mass |
74 u |
| Quality |
998 |
| Retention Index |
489 |
| SMILES |
C(OC)(=O)C |
| SPLASH |
splash10-0006-9000000000-58a38ed0e78bed336591 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Methyl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009739 |
