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3-(6-Amino-5-cyano-3-isopropyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl 2-furoate
SpectraBase Compound ID 4BvkIgny8eJ
InChI InChI=1S/C21H18N4O4/c1-11(2)18-17-16(14(10-22)19(23)29-20(17)25-24-18)12-5-3-6-13(9-12)28-21(26)15-7-4-8-27-15/h3-9,11,16H,23H2,1-2H3,(H,24,25)
InChIKey WZHSKTCHDSJCRE-UHFFFAOYSA-N
Mol Weight 390.4 g/mol
Molecular Formula C21H18N4O4
Exact Mass 390.132805 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5PUokrIkKru
Name 3-(6-Amino-5-cyano-3-isopropyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl 2-furoate
Alternate Name(s) Furan-2-carboxylic acid 3-(6-amino-5-cyano-3-isopropyl-1,4-dihydro-pyrano[2,3-c]pyrazol-4-yl)-phenyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18N4O4
InChI InChI=1S/C21H18N4O4/c1-11(2)18-17-16(14(10-22)19(23)29-20(17)25-24-18)12-5-3-6-13(9-12)28-21(26)15-7-4-8-27-15/h3-9,11,16H,23H2,1-2H3,(H,24,25)
InChIKey WZHSKTCHDSJCRE-UHFFFAOYSA-N
Molecular Weight 390.399 g/mol
SMILES NC1=C(C(c2c(O1)[nH]nc2C(C)C)c1cc(OC(c2occc2)=O)ccc1)C#N
SPLASH splash10-0002-9310000000-8773b8ebd3bb7d09deb2
Wiley ID 1453657