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bicyclo[3.2.0]hepta-2,6-diene-1-carbonitrile
SpectraBase Compound ID 2CoBC5VylLl
InChI InChI=1S/C8H7N/c9-6-8-4-1-2-7(8)3-5-8/h1,3-5,7H,2H2
InChIKey LQHVZDCJHLXDGZ-UHFFFAOYSA-N
Mol Weight 117.15 g/mol
Molecular Formula C8H7N
Exact Mass 117.057849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2fu3B5IQ7QI
Name bicyclo[3.2.0]hepta-2,6-diene-1-carbonitrile
CAS Registry Number 99028-91-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7N
InChI InChI=1S/C8H7N/c9-6-8-4-1-2-7(8)3-5-8/h1,3-5,7H,2H2
InChIKey LQHVZDCJHLXDGZ-UHFFFAOYSA-N
Molecular Weight 117.151 g/mol
SMILES C12(C=CC2CC=C1)C#N
SPLASH splash10-014l-7900000000-1bffa76af0017978cc35
Source of Spectrum K-118-3510-10
Wiley ID 1126167