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(R)-6-(3-methoxyphenyl)-3-methyl-4-(nitromethyl)-1-phenyl-1,4-dihydropyrano[2,3-c]pyrazole
SpectraBase Compound ID K0S7SQTyHH0
InChI InChI=1S/C21H19N3O4/c1-14-20-16(13-23(25)26)12-19(15-7-6-10-18(11-15)27-2)28-21(20)24(22-14)17-8-4-3-5-9-17/h3-12,16H,13H2,1-2H3/t16-/m0/s1
InChIKey RNIIBHFPQBTXKQ-INIZCTEOSA-N
Mol Weight 377.4 g/mol
Molecular Formula C21H19N3O4
Exact Mass 377.137556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HYSv5wWs85n
Name (R)-6-(3-methoxyphenyl)-3-methyl-4-(nitromethyl)-1-phenyl-1,4-dihydropyrano[2,3-c]pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N3O4
InChI InChI=1S/C21H19N3O4/c1-14-20-16(13-23(25)26)12-19(15-7-6-10-18(11-15)27-2)28-21(20)24(22-14)17-8-4-3-5-9-17/h3-12,16H,13H2,1-2H3/t16-/m0/s1
InChIKey RNIIBHFPQBTXKQ-INIZCTEOSA-N
Literature Reference DOI 10.1039/c4cc09495f
Molecular Weight 377.400 g/mol
SMILES C=1(Oc2c(c(n[n]2-c2ccccc2)C)[C@](C[N+](=O)[O-])(C1)[H])c1cc(ccc1)OC
SPLASH splash10-0159-1009000000-fc79a749d7f8f7c34931
Source of Spectrum KD-51-2266/SM-4f
Wiley ID 1757573