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2-[4-(Chloromethyl)phenyl]oxirane
SpectraBase Compound ID JLEPO90ZHTm
InChI InChI=1S/C9H9ClO/c10-5-7-1-3-8(4-2-7)9-6-11-9/h1-4,9H,5-6H2
InChIKey AGFIGKPKGDFQPI-UHFFFAOYSA-N
Mol Weight 168.62 g/mol
Molecular Formula C9H9ClO
Exact Mass 168.034193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CKsASiCXjWq
Name 2-[4-(Chloromethyl)phenyl]oxirane
Appearance Solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9ClO
InChI InChI=1S/C9H9ClO/c10-5-7-1-3-8(4-2-7)9-6-11-9/h1-4,9H,5-6H2
InChIKey AGFIGKPKGDFQPI-UHFFFAOYSA-N
Instrument Name Waters Quattro LC and Bruker MicroTof
Ionization Type EI
Literature Reference DOI 10.1021/jm8015014
Molecular Weight 168.623 g/mol
SMILES C(Cl)c1ccc(cc1)C1OC1
SPLASH splash10-0gb9-1900000000-1193c6caca4f75c0ae1f
Source of Spectrum AF-52-SM12-25
Wiley ID 1873538