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3-Buten-2-one, 4-(2-chlorophenyl)-
SpectraBase Compound ID GSEfLTlJoa6
InChI InChI=1S/C10H9ClO/c1-8(12)6-7-9-4-2-3-5-10(9)11/h2-7H,1H3/b7-6+
InChIKey FHDSETHROOWFCQ-VOTSOKGWSA-N
Mol Weight 180.63 g/mol
Molecular Formula C10H9ClO
Exact Mass 180.034193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dn4O12jAHPk
Name (o-Chlorobenzylidene)acetone
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 180.034192609 u
Formula C10H9ClO
InChI InChI=1S/C10H9ClO/c1-8(12)6-7-9-4-2-3-5-10(9)11/h2-7H,1H3/b7-6+
InChIKey FHDSETHROOWFCQ-VOTSOKGWSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 180.634 g/mol
Nominal Mass 180 u
Quality 949
Retention Index 1253
SMILES C=1(C(=CC=CC1)Cl)\C=C\C(=O)C
SPLASH splash10-0f6t-2900000000-a0f74ecd03e713e778d6
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-(2-Chlorophenyl)but-3-en-2-one
Technique GC/MS
Wiley ID DD2024_030700