| SpectraBase Spectrum ID |
BNpY1f7JvDh |
| Name |
Isobutyl phenylacetate |
| CAS Registry Number |
102-13-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16O2 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C12H16O2/c1-10(2)9-14-12(13)8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3 |
| InChIKey |
RJASFPFZACBKBE-UHFFFAOYSA-N |
| Molecular Weight |
192.258 g/mol |
| SMILES |
c1cc(CC(=O)OCC(C)C)ccc1 |
| SPLASH |
splash10-0006-9100000000-703ad83ec32cc8cd3da2 |
| Source |
ex ALDRICH |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
1886505 |
