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AXEMOQXUMAKNAP-XFXZXTDPSA-N
SpectraBase Compound ID AHep1FXd3ZO
InChI InChI=1S/C13H20ClNO/c1-10(14)7-8-12(15)9-13(16)11-5-3-2-4-6-11/h5,9-10H,2-4,6-8,15H2,1H3/b12-9-
InChIKey AXEMOQXUMAKNAP-XFXZXTDPSA-N
Mol Weight 241.76 g/mol
Molecular Formula C13H20ClNO
Exact Mass 241.123342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C7WO63NazBh
Name 3-Amino-6-chloro-1-(Cyclohexenyl)hept-2-en-1-one
Alternate Name(s) 3-Amino-6-chloro-1-(cyclohexenyl)hept-2-en-1-one (wrong name?)
CAS Registry Number 141346-22-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20ClNO
InChI InChI=1S/C13H20ClNO/c1-10(14)7-8-12(15)9-13(16)11-5-3-2-4-6-11/h5,9-10H,2-4,6-8,15H2,1H3/b12-9-
InChIKey AXEMOQXUMAKNAP-XFXZXTDPSA-N
Molecular Weight 241.762 g/mol
SMILES N\C(=C/C(C1=CCCCC1)=O)CCC(Cl)C
SPLASH splash10-0a6r-0690000000-57eaa21d597a68558e3d
Source of Spectrum J-57-4210-7h
Wiley ID 1203590