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(1R*,3S*,6S*)-3-Heptylbicyclo[4.1.0]heptan-2-one
SpectraBase Compound ID 8Exf2o6URdU
InChI InChI=1S/C14H24O/c1-2-3-4-5-6-7-11-8-9-12-10-13(12)14(11)15/h11-13H,2-10H2,1H3/t11-,12-,13+/m0/s1
InChIKey KNRHYKHOHBWULT-RWMBFGLXSA-N
Mol Weight 208.34 g/mol
Molecular Formula C14H24O
Exact Mass 208.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID WVXRGyHGNf
Name (1R*,3S*,6S*)-3-Heptylbicyclo[4.1.0]heptan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O
InChI InChI=1S/C14H24O/c1-2-3-4-5-6-7-11-8-9-12-10-13(12)14(11)15/h11-13H,2-10H2,1H3/t11-,12-,13+/m0/s1
InChIKey KNRHYKHOHBWULT-RWMBFGLXSA-N
Molecular Weight 208.345 g/mol
SMILES [C@@]12(C[C@@]2(CC[C@@](C1=O)(CCCCCCC)[H])[H])[H]
SPLASH splash10-03di-2900000000-31efe6695c8364f827ab
Source of Spectrum F-54-2676-11
Synonyms (1R,3S,6S)-3-heptylbicyclo[4.1.0]heptan-2-one
Wiley ID 806207