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1-Butanone, 2-methyl-4-nitro-1,3-diphenyl-, (2,4-dinitrophenyl)hydrazone, (R*,S*)-
SpectraBase Compound ID 5ImWTkKPAiQ
InChI InChI=1S/C23H21N5O6/c1-16(20(15-26(29)30)17-8-4-2-5-9-17)23(18-10-6-3-7-11-18)25-24-21-13-12-19(27(31)32)14-22(21)28(33)34/h2-14,16,20,24H,15H2,1H3/b25-23+/t16-,20+/m1/s1
InChIKey UUNHZYNAFHHDRZ-LUOIHOMFSA-N
Mol Weight 463.45 g/mol
Molecular Formula C23H21N5O6
Exact Mass 463.149183 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GSwxqxE8t9k
Name 1-Butanone, 2-methyl-4-nitro-1,3-diphenyl-, (2,4-dinitrophenyl)hydrazone, (R*,S*)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 463.149183410 u
Formula C23H21N5O6
InChI InChI=1S/C23H21N5O6/c1-16(20(15-26(29)30)17-8-4-2-5-9-17)23(18-10-6-3-7-11-18)25-24-21-13-12-19(27(31)32)14-22(21)28(33)34/h2-14,16,20,24H,15H2,1H3/b25-23+/t16-,20+/m1/s1
InChIKey UUNHZYNAFHHDRZ-LUOIHOMFSA-N
Molecular Weight 463.450 g/mol
SMILES C1(N(=O)=O)=CC(N(=O)=O)=CC=C1N\N=C/([C@@]([C@](CN(=O)=O)(C1=CC=CC=C1)[H])(C)[H])C=1C=CC=CC1