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Benzene, 2-(1-chloroethenyl)-5-methoxy-1,3-dimethyl-

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Benzene, 2-(1-chloroethenyl)-5-methoxy-1,3-dimethyl-
SpectraBase Compound ID 5wtBWeDYQJd
InChI InChI=1S/C11H13ClO/c1-7-5-10(13-4)6-8(2)11(7)9(3)12/h5-6H,3H2,1-2,4H3
InChIKey AKJIAFWQKMNCHQ-UHFFFAOYSA-N
Mol Weight 196.68 g/mol
Molecular Formula C11H13ClO
Exact Mass 196.065493 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6WjLTDYXpJN
Name Benzene, 2-(1-chloroethenyl)-5-methoxy-1,3-dimethyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 196.065492738 u
Formula C11H13ClO
InChI InChI=1S/C11H13ClO/c1-7-5-10(13-4)6-8(2)11(7)9(3)12/h5-6H,3H2,1-2,4H3
InChIKey AKJIAFWQKMNCHQ-UHFFFAOYSA-N
Molecular Weight 196.677 g/mol
SMILES C=1(C(=CC(=CC1C)OC)C)C(=C)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.940236