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(2R,3R)-1-Cyano-2-p-tolyl-2,3-dihyro-pyrrolo[2,1-a]isoquinoline-3-carboxylic acid ethyl ester
SpectraBase Compound ID IGjvHTSbPim
InChI InChI=1S/C23H20N2O2/c1-3-27-23(26)22-20(17-10-8-15(2)9-11-17)19(14-24)21-18-7-5-4-6-16(18)12-13-25(21)22/h4-13,20,22H,3H2,1-2H3/t20-,22-/m1/s1
InChIKey PGNHHBOVVKGILN-IFMALSPDSA-N
Mol Weight 356.43 g/mol
Molecular Formula C23H20N2O2
Exact Mass 356.152478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jVY94gP515
Name (2R,3R)-1-Cyano-2-p-tolyl-2,3-dihyro-pyrrolo[2,1-a]isoquinoline-3-carboxylic acid ethyl ester
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H20N2O2
InChI InChI=1S/C23H20N2O2/c1-3-27-23(26)22-20(17-10-8-15(2)9-11-17)19(14-24)21-18-7-5-4-6-16(18)12-13-25(21)22/h4-13,20,22H,3H2,1-2H3/t20-,22-/m1/s1
InChIKey PGNHHBOVVKGILN-IFMALSPDSA-N
Molecular Weight 356.425 g/mol
SMILES C1=2N([C@]([C@@](C2C#N)(c2ccc(cc2)C)[H])(C(=O)OCC)[H])C=Cc2c1cccc2
SPLASH splash10-0a4i-0009000000-82d41fe4282d5d045c5b
Source of Spectrum F-67-2321-2b
Synonyms Ethyl 3-cyano-2-(4-methylphenyl)dihydropyrrolro[2,1-a]isoquinoline1-carboxylate
Wiley ID 1686103