| SpectraBase Spectrum ID |
2YBenTTBl3P |
| Name |
Phenyl ethyl 3-methyl butanoate |
| CAS Registry Number |
140-26-1 |
| 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 |
206.130679818 u |
| Formula |
C13H18O2 |
| 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/C13H18O2/c1-11(2)10-13(14)15-9-8-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3 |
| InChIKey |
JIMGVOCOYZFDKB-UHFFFAOYSA-N |
| Molecular Weight |
206.285 g/mol |
| Nominal Mass |
206 u |
| Number of Peaks |
76 |
| SMILES |
C(Cc1ccccc1)OC(CC(C)C)=O |
| SPLASH |
splash10-0zfr-8900000000-d1e8876840a3f1a5d0be |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA001093 |
