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1-benzoylcyclopropanecarbonitrile
SpectraBase Compound ID 6hYBqYOJpJp
InChI InChI=1S/C11H9NO/c12-8-11(6-7-11)10(13)9-4-2-1-3-5-9/h1-5H,6-7H2
InChIKey BFTNAMCEYMRHDC-UHFFFAOYSA-N
Mol Weight 171.2 g/mol
Molecular Formula C11H9NO
Exact Mass 171.068414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FsG7Qr8pUEV
Name 1-benzoylcyclopropanecarbonitrile
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 171.068413913 u
Formula C11H9NO
InChI InChI=1S/C11H9NO/c12-8-11(6-7-11)10(13)9-4-2-1-3-5-9/h1-5H,6-7H2
InChIKey BFTNAMCEYMRHDC-UHFFFAOYSA-N
Instrument Name SHIMADZU GCMS-QP2010 and JEOL JMS-DX303HF
Ionization Type EI
Literature Reference DOI 10.1002/anie.201605445
Molecular Weight 171.199 g/mol
Quality 172
Reported Formula C11H9NO
SMILES C1(=CC=CC=C1)C(=O)C1(CC1)C#N
SPLASH splash10-0a6r-7900000000-49e31416516f775d63c0
Source of Spectrum ACI-55-SM25-2ab (DOI: 10.1002/anie.201605445)
Wiley ID 1899101