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4-[(1S,6S)-Bicyclo[4.1.0]hept-1-yl]butyronitrile
SpectraBase Compound ID KW3ZAXxpLWr
InChI InChI=1S/C11H17N/c12-8-4-3-7-11-6-2-1-5-10(11)9-11/h10H,1-7,9H2/t10-,11-/m0/s1
InChIKey KJYJMBRWNWOOQL-QWRGUYRKSA-N
Mol Weight 163.26 g/mol
Molecular Formula C11H17N
Exact Mass 163.1361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K8x9bOTj2Ak
Name 4-[(1S,6S)-Bicyclo[4.1.0]hept-1-yl]butyronitrile
Alternate Name(s) 4-[(1S,6S)-bicyclo[4.1.0]hept-1-yl]butanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17N
InChI InChI=1S/C11H17N/c12-8-4-3-7-11-6-2-1-5-10(11)9-11/h10H,1-7,9H2/t10-,11-/m0/s1
InChIKey KJYJMBRWNWOOQL-QWRGUYRKSA-N
Molecular Weight 163.264 g/mol
SMILES [C@@]12(C[C@@]2(CCCC1)[H])CCCC#N
SPLASH splash10-0002-9000000000-dcc54575fd483f02cb09
Source of Spectrum E1-41-2036-10
Wiley ID 1552296