John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=1OmXSobdFYj SpectraBase Spectrum ID=iKq7WePlAW

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(2R*,3S*)-3-Butyl-2-ethenylcycloheptanone
SpectraBase Compound ID 1OmXSobdFYj
InChI InChI=1S/C13H22O/c1-3-5-8-11-9-6-7-10-13(14)12(11)4-2/h4,11-12H,2-3,5-10H2,1H3/t11-,12+/m0/s1
InChIKey UEPSWFRPNSZZBV-NWDGAFQWSA-N
Mol Weight 194.32 g/mol
Molecular Formula C13H22O
Exact Mass 194.167065 g/mol

Mass Spectrum (MS)

Mass Spectrum (MS)

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SpectraBase Spectrum ID iKq7WePlAW
Name (2R*,3S*)-3-Butyl-2-ethenylcycloheptanone
Alternate Name(s) (2R,3S)-3-butyl-2-vinylcycloheptanone
Classification Cyclic ketones
Comments Less than 3 mono-isotopic peaks
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Formula C13H22O
InChI InChI=1S/C13H22O/c1-3-5-8-11-9-6-7-10-13(14)12(11)4-2/h4,11-12H,2-3,5-10H2,1H3/t11-,12+/m0/s1
InChIKey UEPSWFRPNSZZBV-NWDGAFQWSA-N
SPLASH splash10-0005-7900000000-1a2dae32e1e23e35b151
Source of Spectrum SO-0-142-0
SpectraBase Batch ID EBazidqZQLY
Wiley ID 865265