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2-Methyl-2-(methoxycarbonyloxy)-4-phenylbutanenitrile
SpectraBase Compound ID 8kGkVkSKxRF
InChI InChI=1S/C13H15NO3/c1-13(10-14,17-12(15)16-2)9-8-11-6-4-3-5-7-11/h3-7H,8-9H2,1-2H3
InChIKey DTWBVHWXDSDGFS-UHFFFAOYSA-N
Mol Weight 233.27 g/mol
Molecular Formula C13H15NO3
Exact Mass 233.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2JeF5I0sA7U
Name 2-Methyl-2-(methoxycarbonyloxy)-4-phenylbutanenitrile
Alternate Name(s) 1-cyano-1-methyl-3-phenylpropyl methyl carbonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO3
InChI InChI=1S/C13H15NO3/c1-13(10-14,17-12(15)16-2)9-8-11-6-4-3-5-7-11/h3-7H,8-9H2,1-2H3
InChIKey DTWBVHWXDSDGFS-UHFFFAOYSA-N
Molecular Weight 233.267 g/mol
SMILES C(C(CCc1ccccc1)(OC(=O)OC)C)#N
SPLASH splash10-0a4i-2900000000-0914a7d23095858f17f8
Source of Spectrum F4-0-2794-2
Wiley ID 1618857