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(R)-6-Butyl-3-methyl-4-(nitromethyl)-1-phenyl-1,4-dihydropyrano[2,3-c]pyrazole
SpectraBase Compound ID GtX4W6Jlkq3
InChI InChI=1S/C18H21N3O3/c1-3-4-10-16-11-14(12-20(22)23)17-13(2)19-21(18(17)24-16)15-8-6-5-7-9-15/h5-9,11,14H,3-4,10,12H2,1-2H3/t14-/m0/s1
InChIKey BJKMZZXTNVIZLV-AWEZNQCLSA-N
Mol Weight 327.38 g/mol
Molecular Formula C18H21N3O3
Exact Mass 327.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4vD46KiHfk
Name (R)-6-Butyl-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 C18H21N3O3
InChI InChI=1S/C18H21N3O3/c1-3-4-10-16-11-14(12-20(22)23)17-13(2)19-21(18(17)24-16)15-8-6-5-7-9-15/h5-9,11,14H,3-4,10,12H2,1-2H3/t14-/m0/s1
InChIKey BJKMZZXTNVIZLV-AWEZNQCLSA-N
Literature Reference DOI 10.1039/c4cc09495f
Molecular Weight 327.384 g/mol
SMILES C=1(CCCC)Oc2[n](nc(c2[C@](C[N+](=O)[O-])(C1)[H])C)-c1ccccc1
SPLASH splash10-0159-0090000000-c8b76e3507a4cdf4e7b7
Source of Spectrum KD-51-2266/SM-4p
Wiley ID 1757580