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(1R*,2S*,3S*)-2-Benzoyl-3-methylcyclopropanecarbonitrile

View entire compound with spectra: 1 MS (GC)

(1R*,2S*,3S*)-2-Benzoyl-3-methylcyclopropanecarbonitrile
SpectraBase Compound ID I2eHMWJnq7y
InChI InChI=1S/C12H11NO/c1-8-10(7-13)11(8)12(14)9-5-3-2-4-6-9/h2-6,8,10-11H,1H3/t8-,10+,11-/m0/s1
InChIKey YJODVCXZBPRUNW-GDPRMGEGSA-N
Mol Weight 185.23 g/mol
Molecular Formula C12H11NO
Exact Mass 185.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JlIgbIMyj07
Name (1R*,2S*,3S*)-2-Benzoyl-3-methylcyclopropanecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NO
InChI InChI=1S/C12H11NO/c1-8-10(7-13)11(8)12(14)9-5-3-2-4-6-9/h2-6,8,10-11H,1H3/t8-,10+,11-/m0/s1
InChIKey YJODVCXZBPRUNW-GDPRMGEGSA-N
Molecular Weight 185.226 g/mol
SMILES [C@@]1([C@](C#N)([C@@]1(C)[H])[H])(C(=O)c1ccccc1)[H]
SPLASH splash10-0a4i-4900000000-47508dea45fe5d33a100
Source of Spectrum F-68-2491-37
Wiley ID 1708629