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2-Chlorobenzoic acid
SpectraBase Compound ID EVMQHOZqwaa
InChI InChI=1S/C7H5ClO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)
InChIKey IKCLCGXPQILATA-UHFFFAOYSA-N
Mol Weight 156.57 g/mol
Molecular Formula C7H5ClO2
Exact Mass 155.997807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JH79c6vcdqi
Name 2-Chlorobenzoic acid
CAS Registry Number 118-91-2
Classification Chemical
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 155.997807099 u
Formula C7H5ClO2
InChI InChI=1S/C7H5ClO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)
InChIKey IKCLCGXPQILATA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 156.568 g/mol
Nominal Mass 156 u
Quality 992
Retention Index 1330
SMILES OC(C=1C(=CC=CC1)Cl)=O
SPLASH splash10-0a4r-2900000000-b65d2f06d02ab8117d2a
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms o-Chloro-benzoic acid
Technique GC/MS
Wiley ID DD2024_024283