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Benzyl 6-amino-5-cyano-2-methyl-4-phenyl-4H-pyran-3-carboxylate
SpectraBase Compound ID Huqwa2bz1Rs
InChI InChI=1S/C21H18N2O3/c1-14-18(21(24)25-13-15-8-4-2-5-9-15)19(16-10-6-3-7-11-16)17(12-22)20(23)26-14/h2-11,19H,13,23H2,1H3
InChIKey JOHBVQLLXJSGKQ-UHFFFAOYSA-N
Mol Weight 346.39 g/mol
Molecular Formula C21H18N2O3
Exact Mass 346.131742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8bduAT0MlFI
Name Benzyl 6-amino-5-cyano-2-methyl-4-phenyl-4H-pyran-3-carboxylate
Alternate Name(s) (phenylmethyl) 6-azanyl-5-cyano-2-methyl-4-phenyl-4H-pyran-3-carboxylate 4H-Pyran-3-carboxylic acid, 6-amino-5-cyano-2-methyl-4-phenyl-, benzyl ester 6-Amino-5-cyano-2-methyl-4-phenyl-4H-pyran-3-carboxylic acid (phenylmethyl) ester 6-Amino-5-cyano-2-methyl-4-phenyl-4H-pyran-3-carboxylic acid benzyl ester
CAS Registry Number 300589-42-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18N2O3
InChI InChI=1S/C21H18N2O3/c1-14-18(21(24)25-13-15-8-4-2-5-9-15)19(16-10-6-3-7-11-16)17(12-22)20(23)26-14/h2-11,19H,13,23H2,1H3
InChIKey JOHBVQLLXJSGKQ-UHFFFAOYSA-N
Molecular Weight 346.386 g/mol
SMILES NC=1OC(=C(C(C1C#N)c1ccccc1)C(OCc1ccccc1)=O)C
SPLASH splash10-0006-9230000000-1419cc0eb8e50800f854
Source of Spectrum AD-0-2532-0
Wiley ID 1426179