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Carbamodithioic acid, (4-ethoxyphenyl)-, anhydrosulfide with carbamimidothioic acid
SpectraBase Compound ID Epx9Hxfrm41
InChI InChI=1S/C10H13N3OS2/c1-2-14-8-5-3-7(4-6-8)13-10(15)16-9(11)12/h3-6H,2H2,1H3,(H3,11,12)(H,13,15)
InChIKey QCVFKTTWDDJFMO-UHFFFAOYSA-N
Mol Weight 255.35 g/mol
Molecular Formula C10H13N3OS2
Exact Mass 255.050004 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LujVcmZ2kT
Name Carbamodithioic acid, (4-ethoxyphenyl)-, anhydrosulfide with carbamimidothioic acid
Alternate Name(s) N-(4-ethoxyphenyl)(carbamimidoylsulfanyl)carbothioamide S-(n-p-ethoxyphenylthiocarbamyl)isothiourea
CAS Registry Number 60791-35-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13N3OS2
InChI InChI=1S/C10H13N3OS2/c1-2-14-8-5-3-7(4-6-8)13-10(15)16-9(11)12/h3-6H,2H2,1H3,(H3,11,12)(H,13,15)
InChIKey QCVFKTTWDDJFMO-UHFFFAOYSA-N
Molecular Weight 255.354 g/mol
SMILES N=C(SC(Nc1ccc(cc1)OCC)=S)N
SPLASH splash10-0kdl-9600000000-7541595e86f08116c82e
Source of Spectrum B-29-423-0
Wiley ID 1258563