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1-Benzoyl-4,5-dihydro-1H-pyrazole-3-carbonitrile
SpectraBase Compound ID Ei3OugBwNGk
InChI InChI=1S/C11H9N3O/c12-8-10-6-7-14(13-10)11(15)9-4-2-1-3-5-9/h1-5H,6-7H2
InChIKey GGKHPJZERCQKQW-UHFFFAOYSA-N
Mol Weight 199.21 g/mol
Molecular Formula C11H9N3O
Exact Mass 199.074562 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BKeXb73uXyq
Name 1-Benzoyl-4,5-dihydro-1H-pyrazole-3-carbonitrile
Alternate Name(s) 1-Benzoyl-2-pyrazoline-3-carbonitrile 2-(Phenylcarbonyl)-3,4-dihydropyrazole-5-carbonitrile 2-Benzoyl-3,4-dihydropyrazole-5-carbonitrile 2-Pyrazoline-3-carbonitrile, 1-benzoyl-
CAS Registry Number 67872-68-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9N3O
InChI InChI=1S/C11H9N3O/c12-8-10-6-7-14(13-10)11(15)9-4-2-1-3-5-9/h1-5H,6-7H2
InChIKey GGKHPJZERCQKQW-UHFFFAOYSA-N
Molecular Weight 199.213 g/mol
SMILES C=1(CCN(N1)C(c1ccccc1)=O)C#N
SPLASH splash10-0a6r-9600000000-5e95100cb972cad102ba
Source of Spectrum AD-0-2532-0
Wiley ID 1421317