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1-Chloro-4-phenyl-3-buten-2-one
SpectraBase Compound ID 4XqNeMSPJV1
InChI InChI=1S/C10H9ClO/c11-8-10(12)7-6-9-4-2-1-3-5-9/h1-7H,8H2/b7-6+
InChIKey PANXYZZXJIDXMI-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 LC5RXsy4VIG
Name 1-Chloro-4-phenyl-3-buten-2-one
Alternate Name(s) (E)-1-chloranyl-4-phenyl-but-3-en-2-one (E)-1-chloro-4-phenyl-3-buten-2-one (E)-1-chloro-4-phenyl-but-3-en-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C10H9ClO
InChI InChI=1S/C10H9ClO/c11-8-10(12)7-6-9-4-2-1-3-5-9/h1-7H,8H2/b7-6+
InChIKey PANXYZZXJIDXMI-VOTSOKGWSA-N
Molecular Weight 180.634 g/mol
SMILES C(C(\C=C\c1ccccc1)=O)Cl
SPLASH splash10-001i-0900000000-9951740ce974f5413300
Source of Spectrum F-51-709-17
Wiley ID 790604