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Carbonic acid, 2-chloroethyl 3-methylphenyl ester

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Carbonic acid, 2-chloroethyl 3-methylphenyl ester
SpectraBase Compound ID 8Vxi8r8AFat
InChI InChI=1S/C10H11ClO3/c1-8-3-2-4-9(7-8)14-10(12)13-6-5-11/h2-4,7H,5-6H2,1H3
InChIKey JQLPWUSEVZRGGN-UHFFFAOYSA-N
Mol Weight 214.65 g/mol
Molecular Formula C10H11ClO3
Exact Mass 214.039672 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9t5fQQdkspW
Name Carbonic acid, 2-chloroethyl 3-methylphenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 214.039671911 u
Formula C10H11ClO3
InChI InChI=1S/C10H11ClO3/c1-8-3-2-4-9(7-8)14-10(12)13-6-5-11/h2-4,7H,5-6H2,1H3
InChIKey JQLPWUSEVZRGGN-UHFFFAOYSA-N
Molecular Weight 214.648 g/mol
SMILES C(CCl)OC(=O)OC1=CC(C)=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.887811