For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Dimethyl 2,2-[(1,3-dimethyl-4,6-dioxo-2-thioxohexahydropyrimidine-5,5-diyl)]bis{3-[(anilinocarbonyl)hydrazono]butanoate}
SpectraBase Compound ID 20KtTQ10hTh
InChI InChI=1S/C32H38N8O8S/c1-7-39-27(43)32(28(44)40(8-2)31(39)49,23(25(41)47-5)19(3)35-37-29(45)33-21-15-11-9-12-16-21)24(26(42)48-6)20(4)36-38-30(46)34-22-17-13-10-14-18-22/h9-18,23-24H,7-8H2,1-6H3,(H2,33,37,45)(H2,34,38,46)
InChIKey HFXYZWPIEOVQON-UHFFFAOYSA-N
Mol Weight 694.8 g/mol
Molecular Formula C32H38N8O8S
Exact Mass 694.253331 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3fDkCwLvKE8
Name Dimethyl 2,2-[(1,3-dimethyl-4,6-dioxo-2-thioxohexahydropyrimidine-5,5-diyl)]bis{3-[(anilinocarbonyl)hydrazono]butanoate}
Alternate Name(s) Dimethyl 2,2'-(1,3-diethyl-4,6-dioxo-2-thioxohexahydropyrimidine-5,5-diyl)bis(3-(2-(phenylcarbamoyl)hydrazineylidene)butanoate)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H38N8O8S
InChI InChI=1S/C32H38N8O8S/c1-7-39-27(43)32(28(44)40(8-2)31(39)49,23(25(41)47-5)19(3)35-37-29(45)33-21-15-11-9-12-16-21)24(26(42)48-6)20(4)36-38-30(46)34-22-17-13-10-14-18-22/h9-18,23-24H,7-8H2,1-6H3,(H2,33,37,45)(H2,34,38,46)
InChIKey HFXYZWPIEOVQON-UHFFFAOYSA-N
Molecular Weight 694.764 g/mol
SMILES N(N=C(C(C1(C(C(=NNC(=O)Nc2ccccc2)C)C(=O)OC)C(N(C(N(C1=O)CC)=S)CC)=O)C(=O)OC)C)C(=O)Nc1ccccc1
SPLASH splash10-01b9-0009730000-8b66be2a4992a3e5ebc2
Source of Spectrum F-71-7286-3g
Wiley ID 1803110