| SpectraBase Spectrum ID |
HHcQ70jNSCo |
| Name |
Hydroxy(4-benzyloxy-3-chlorophenyl)acetic acid,methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
306.065886659 u |
| Formula |
C16H15ClO4 |
| InChI |
InChI=1S/C16H15ClO4/c1-20-16(19)15(18)12-7-8-14(13(17)9-12)21-10-11-5-3-2-4-6-11/h2-9,15,18H,10H2,1H3 |
| InChIKey |
GYCLRQVKEOESNN-UHFFFAOYSA-N |
| Molecular Weight |
306.745 g/mol |
| SMILES |
C1(=CC=C(C=C1Cl)C(C(=O)OC)O)OCC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.898728 |
