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2-Chloroethylbenzene
SpectraBase Compound ID Ct0xgZaXmyR
InChI InChI=1S/C8H9Cl/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey MNNZINNZIQVULG-UHFFFAOYSA-N
Mol Weight 140.61 g/mol
Molecular Formula C8H9Cl
Exact Mass 140.039278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGXB39npudM
Name Phenethyl chloride
CAS Registry Number 622-24-2
Classification Designer drug precursor
Comments Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 140.039277990 u
Formula C8H9Cl
InChI InChI=1S/C8H9Cl/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey MNNZINNZIQVULG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 140.613 g/mol
Nominal Mass 140 u
Quality 939
Retention Index 1083
SMILES C1(=CC=CC=C1)CCCl
SPLASH splash10-0006-9100000000-3ac079b917b578755e9f
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-Chloroethylbenzene (2-chloroethyl)benzene
Technique GC/MS
Wiley ID DD2024_032421