SpectraBase Spectrum ID |
GYzBnse58Mq |
Name |
Phenacylidene diacetate |
CAS Registry Number |
5062-30-6 |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
236.068473481 u |
Formula |
C12H12O5 |
InChI |
InChI=1S/C12H12O5/c1-8(13)16-12(17-9(2)14)11(15)10-6-4-3-5-7-10/h3-7,12H,1-2H3 |
InChIKey |
LMFOAVVKMLWZOS-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
236.223 g/mol |
Nominal Mass |
236 u |
Quality |
911 |
Retention Index |
1693 |
SMILES |
C(C(C1=CC=CC=C1)=O)(OC(=O)C)OC(=O)C |
SPLASH |
splash10-0a4i-6900000000-84ddb69fc099fd454953 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-(Acetyloxy)-2-oxo-2-phenylethyl acetate
(1-Acetyloxy-2-oxo-2-phenylethyl) acetate |
Technique |
GC/MS |
Wiley ID |
DD2024_010612 |