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(R)-6-(Benzo[d][1,3]dioxol-5-yl)-3-methyl-4-(nitromethyl)-1-phenyl-1,4-dihydropyrano[2,3- c]pyrazole

View entire compound with spectra: 1 MS (GC)

(R)-6-(Benzo[d][1,3]dioxol-5-yl)-3-methyl-4-(nitromethyl)-1-phenyl-1,4-dihydropyrano[2,3- c]pyrazole
SpectraBase Compound ID 7YUOkQh0vV
InChI InChI=1S/C21H17N3O5/c1-13-20-15(11-23(25)26)10-18(14-7-8-17-19(9-14)28-12-27-17)29-21(20)24(22-13)16-5-3-2-4-6-16/h2-10,15H,11-12H2,1H3/t15-/m0/s1
InChIKey AYFOGWVSZSNBLC-HNNXBMFYSA-N
Mol Weight 391.38 g/mol
Molecular Formula C21H17N3O5
Exact Mass 391.116821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKmLkUrujOq
Name (R)-6-(Benzo[d][1,3]dioxol-5-yl)-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 C21H17N3O5
InChI InChI=1S/C21H17N3O5/c1-13-20-15(11-23(25)26)10-18(14-7-8-17-19(9-14)28-12-27-17)29-21(20)24(22-13)16-5-3-2-4-6-16/h2-10,15H,11-12H2,1H3/t15-/m0/s1
InChIKey AYFOGWVSZSNBLC-HNNXBMFYSA-N
Literature Reference DOI 10.1039/c4cc09495f
Molecular Weight 391.383 g/mol
SMILES C=1(c2ccc3c(c2)OCO3)Oc2c([C@](C[N+](=O)[O-])(C1)[H])c(n[n]2-c1ccccc1)C
SPLASH splash10-001i-2509000000-a29f4fbca2298c9b333e
Source of Spectrum KD-51-2266/SM-4g
Synonyms (R)-6-(benzo[d][1,3]dioxol-5-yl)-3-methyl-4-(nitromethyl)-1-phenyl-1,4-dihydropyrano[2,3-c]pyrazole
Wiley ID 1757574