| SpectraBase Spectrum ID |
3mBOFfGGwkQ |
| Name |
Hexanoic acid, 4-oxo-6-(phenylmethoxy)-, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
264.136159120 u |
| Formula |
C15H20O4 |
| InChI |
InChI=1S/C15H20O4/c1-2-19-15(17)9-8-14(16)10-11-18-12-13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3 |
| InChIKey |
IGFHOAYLBRNFTP-UHFFFAOYSA-N |
| Molecular Weight |
264.321 g/mol |
| SMILES |
C(=O)(CCC(=O)CCOCC1=CC=CC=C1)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.914082 |
