| SpectraBase Spectrum ID |
D8kZ20hELka |
| Name |
Benzene acetic acid, methyl ester |
| CAS Registry Number |
101-41-7 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
150.068079560 u |
| Formula |
C9H10O2 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
| GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
| InChI |
InChI=1S/C9H10O2/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3 |
| InChIKey |
CRZQGDNQQAALAY-UHFFFAOYSA-N |
| Molecular Weight |
150.177 g/mol |
| Nominal Mass |
150 u |
| Number of Peaks |
92 |
| SMILES |
C(Cc1ccccc1)(OC)=O |
| SPLASH |
splash10-0006-9200000000-c83d5241819822f709db |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000136 |
