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Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-(2,5-dichlorophenyl)-
SpectraBase Compound ID 2TZXIoSZz3h
InChI InChI=1S/C12H10Cl2O2/c13-7-1-2-9(14)8(3-7)11-4-12(5-11,6-11)10(15)16/h1-3H,4-6H2,(H,15,16)
InChIKey AMWQJPASQWQZTP-UHFFFAOYSA-N
Mol Weight 257.12 g/mol
Molecular Formula C12H10Cl2O2
Exact Mass 256.005785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1XybqdvBjEN
Name Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-(2,5-dichlorophenyl)-
CAS Registry Number 131515-55-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10Cl2O2
InChI InChI=1S/C12H10Cl2O2/c13-7-1-2-9(14)8(3-7)11-4-12(5-11,6-11)10(15)16/h1-3H,4-6H2,(H,15,16)
InChIKey AMWQJPASQWQZTP-UHFFFAOYSA-N
Molecular Weight 257.116 g/mol
SMILES OC(C12CC(c3c(ccc(c3)Cl)Cl)(C1)C2)=O
SPLASH splash10-0gxt-9200000000-49a48056b446d60effc4
Source of Spectrum J-56-316-5
Synonyms 3-(2,5-Dichlorophenyl)bicyclo[1.1.1]pentane-1-carboxylic acid
Wiley ID 1259363