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2,4,6-Cycloheptatrien-1-one, 2-chloro-7-phenyl-
SpectraBase Compound ID 9pmVR1Qb0Kb
InChI InChI=1S/C13H9ClO/c14-12-9-5-4-8-11(13(12)15)10-6-2-1-3-7-10/h1-9H
InChIKey GSMAZDFUYTUQTD-UHFFFAOYSA-N
Mol Weight 216.67 g/mol
Molecular Formula C13H9ClO
Exact Mass 216.034193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1CLCiDVyGZd
Name 2,4,6-Cycloheptatrien-1-one, 2-chloro-7-phenyl-
CAS Registry Number 90128-01-1
Comments Less than 3 mono-isotopic peaks
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Formula C13H9ClO
InChI InChI=1S/C13H9ClO/c14-12-9-5-4-8-11(13(12)15)10-6-2-1-3-7-10/h1-9H
InChIKey GSMAZDFUYTUQTD-UHFFFAOYSA-N
Molecular Weight 216.667 g/mol
SMILES c1ccc(cc1)C1=CC=CC=C(C1=O)Cl
SPLASH splash10-014i-0190000000-3dc619963bade11201c8
Source of Spectrum KC-1984-202-0
Synonyms 2-Chloro-7-phenyl-2,4,6-cycloheptatrien-1-one 2-chloranyl-7-phenyl-cyclohepta-2,4,6-trien-1-one 2-chloro-7-phenyl-1-cyclohepta-2,4,6-trienone 2-chloro-7-phenyl-cyclohepta-2,4,6-trien-1-one 2-Chloro-7-phenyltropone
Wiley ID 1215654