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S-Benzyl-N-(3,5-dinitrobenzoyl)cysteine N'-(3-methoxy-4-propoxybenzylidene)hydrazide
SpectraBase Compound ID 18N8qQRo6I7
InChI InChI=1S/C28H29N5O8S/c1-3-11-41-25-10-9-20(12-26(25)40-2)16-29-31-28(35)24(18-42-17-19-7-5-4-6-8-19)30-27(34)21-13-22(32(36)37)15-23(14-21)33(38)39/h4-10,12-16,24H,3,11,17-18H2,1-2H3,(H,30,34)(H,31,35)/b29-16+
InChIKey PZODNYAKJATFAC-MUFRIFMGSA-N
Mol Weight 595.63 g/mol
Molecular Formula C28H29N5O8S
Exact Mass 595.173684 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LcXu2qtFU2M
Name S-BENZYL-N-(3,5-DINITROBENZOYL)CYSTEINE N'-(3-METHOXY-4-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H29N5O8S
InChI InChI=1S/C28H29N5O8S/c1-3-11-41-25-10-9-20(12-26(25)40-2)16-29-31-28(35)24(18-42-17-19-7-5-4-6-8-19)30-27(34)21-13-22(32(36)37)15-23(14-21)33(38)39/h4-10,12-16,24H,3,11,17-18H2,1-2H3,(H,30,34)(H,31,35)/b29-16+
InChIKey PZODNYAKJATFAC-MUFRIFMGSA-N
Molecular Weight 595.1730
SMILES N(C(C(N\N=C\c1ccc(OCCC)c(OC)c1)=O)CSCc1ccccc1)C(=O)c1cc(N(=O)=O)cc(N(=O)=O)c1
SPLASH splash10-0006-9300000000-46c0df8e928e9059d7f7
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany