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4-Methoxycarbonyl-2-cyano-3-methyl-5-phenylpyrrolidine
SpectraBase Compound ID oelnyubrDq
InChI InChI=1S/C14H16N2O2/c1-9-11(8-15)16-13(12(9)14(17)18-2)10-6-4-3-5-7-10/h3-7,9,11-13,16H,1-2H3
InChIKey VPTFVHPYMABDRZ-UHFFFAOYSA-N
Mol Weight 244.29 g/mol
Molecular Formula C14H16N2O2
Exact Mass 244.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5NCz0CR29K
Name Methyl 2-cyano-3-methyl-5-phenylpyrrolidine-4-carboxylate ((2s)2,3-cis-3,4-trans-4,5-cis)
Alternate Name(s) Methyl (2s,3r,4r,5s)-2-cyano-3-methyl-5-phenylpyrrolidine-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N2O2
InChI InChI=1S/C14H16N2O2/c1-9-11(8-15)16-13(12(9)14(17)18-2)10-6-4-3-5-7-10/h3-7,9,11-13,16H,1-2H3
InChIKey VPTFVHPYMABDRZ-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 244.294 g/mol
SMILES N1C(C(C(C1c1ccccc1)C(OC)=O)C)C#N
SPLASH splash10-01ow-2900000000-435fed9691fb34533fff
Source of Spectrum SRH-2022-10281-0
Wiley ID 1831900