SpectraBase Spectrum ID |
1vpdwyq1VwN |
Name |
Carbonic acid, 2-chloroethyl 4-methoxyphenyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
230.034586530 u |
Formula |
C10H11ClO4 |
InChI |
InChI=1S/C10H11ClO4/c1-13-8-2-4-9(5-3-8)15-10(12)14-7-6-11/h2-5H,6-7H2,1H3 |
InChIKey |
PFYLWBGYOBTSRT-UHFFFAOYSA-N |
Molecular Weight |
230.647 g/mol |
SMILES |
C(CCl)OC(=O)OC1=CC=C(OC)C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.941595 |