| SpectraBase Spectrum ID |
2nTpDJNcTnE |
| Name |
1-Phenylethyl acetate |
| CAS Registry Number |
93-92-5 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
164.083729624 u |
| Formula |
C10H12O2 |
| InChI |
InChI=1S/C10H12O2/c1-8(12-9(2)11)10-6-4-3-5-7-10/h3-8H,1-2H3 |
| InChIKey |
QUMXDOLUJCHOAY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
164.204 g/mol |
| Nominal Mass |
164 u |
| Quality |
1000 |
| Retention Index |
1183 |
| SMILES |
C1(C(OC(=O)C)C)=CC=CC=C1 |
| SPLASH |
splash10-0kkc-5900000000-bff61e3f84b096388171 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-phenylethyl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_034991 |
