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3,4,5-trimethoxybenzaldehyde, thiocarbohydrazone

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

3,4,5-trimethoxybenzaldehyde, thiocarbohydrazone
SpectraBase Compound ID DQAQs0YQKud
InChI InChI=1S/C21H26N4O6S/c1-26-15-7-13(8-16(27-2)19(15)30-5)11-22-24-21(32)25-23-12-14-9-17(28-3)20(31-6)18(10-14)29-4/h7-12H,1-6H3,(H2,24,25,32)/b22-11+,23-12+
InChIKey FVDYLAUVYKMISU-LCHFAGMQSA-N
Mol Weight 462.52 g/mol
Molecular Formula C21H26N4O6S
Exact Mass 462.157306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3DFgY3G4xs
Name 1-Hydrazinecarbothioic acid, 2-[(3,4,5-trimethoxyphenyl)methylidene]-, N'-[(3,4,5-trimethoxyphenyl)methylidene]hydrazide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N4O6S
InChI InChI=1S/C21H26N4O6S/c1-26-15-7-13(8-16(27-2)19(15)30-5)11-22-24-21(32)25-23-12-14-9-17(28-3)20(31-6)18(10-14)29-4/h7-12H,1-6H3,(H2,24,25,32)/b22-11+,23-12+
InChIKey FVDYLAUVYKMISU-LCHFAGMQSA-N
Molecular Weight 462.521 g/mol
SMILES N(\N=C\c1cc(OC)c(c(c1)OC)OC)C(=S)N\N=C\c1cc(OC)c(c(c1)OC)OC
SPLASH splash10-0ikd-3940000000-f4b39cce56c7ec926938
Source of Spectrum IY-1-4621-4
Synonyms 1,3-bis[(E)-(3,4,5-trimethoxyphenyl)methyleneamino]thiourea 1,3-bis[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]thiourea
Wiley ID 1654197