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4-(2-Chlorophenyl)heptan-2-one
SpectraBase Compound ID LvkhQr1iysz
InChI InChI=1S/C13H17ClO/c1-3-6-11(9-10(2)15)12-7-4-5-8-13(12)14/h4-5,7-8,11H,3,6,9H2,1-2H3/t11-/m1/s1
InChIKey YNADMCSWMQVZRR-LLVKDONJSA-N
Mol Weight 224.73 g/mol
Molecular Formula C13H17ClO
Exact Mass 224.096793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1dSzWVMhGrH
Name 4-(2-Chlorophenyl)heptan-2-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17ClO
InChI InChI=1S/C13H17ClO/c1-3-6-11(9-10(2)15)12-7-4-5-8-13(12)14/h4-5,7-8,11H,3,6,9H2,1-2H3/t11-/m1/s1
InChIKey YNADMCSWMQVZRR-LLVKDONJSA-N
Literature Reference DOI 10.1021/ol801665z
Molecular Weight 224.731 g/mol
SMILES c1ccc(c(c1)[C@@](CC(C)=O)(CCC)[H])Cl
SPLASH splash10-000f-9800000000-14480e6246e24ca5de26
Source of Spectrum A1-10-4101/SMS22-9dl
Synonyms (R)-4-(2-chlorophenyl)heptan-2-one
Wiley ID 1759842