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3-(5-Hydroxy-3-phenyl-1H-pyrazol-1-yl)propanenitrile
SpectraBase Compound ID 8XeTYXHGKTl
InChI InChI=1S/C12H11N3O/c13-7-4-8-15-12(16)9-11(14-15)10-5-2-1-3-6-10/h1-3,5-6,9,16H,4,8H2
InChIKey MKLARMJYBRGTLY-UHFFFAOYSA-N
Mol Weight 213.24 g/mol
Molecular Formula C12H11N3O
Exact Mass 213.090212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JoOFDo5VdZh
Name 3-(5-Hydroxy-3-phenyl-1H-pyrazol-1-yl)propanenitrile
Alternate Name(s) Propanenitrile, 3-(5-hydroxy-3-phenyl-1-pyrazolyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N3O
InChI InChI=1S/C12H11N3O/c13-7-4-8-15-12(16)9-11(14-15)10-5-2-1-3-6-10/h1-3,5-6,9,16H,4,8H2
InChIKey MKLARMJYBRGTLY-UHFFFAOYSA-N
Molecular Weight 213.240 g/mol
SMILES Oc1[n](nc(c1)-c1ccccc1)CCC#N
SPLASH splash10-0umi-7920000000-5ced1cddb9da3685e8c8
Source of Spectrum AD-0-2532-0
Wiley ID 1435607