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2-(4-Thioureidobenzamido)acetic acid

View entire compound with spectra: 1 MS (GC)

2-(4-Thioureidobenzamido)acetic acid
SpectraBase Compound ID Domzpq3vnIA
InChI InChI=1S/C10H11N3O3S/c11-10(17)13-7-3-1-6(2-4-7)9(16)12-5-8(14)15/h1-4H,5H2,(H,12,16)(H,14,15)(H3,11,13,17)
InChIKey STRSFHNACPMLMQ-UHFFFAOYSA-N
Mol Weight 253.28 g/mol
Molecular Formula C10H11N3O3S
Exact Mass 253.052112 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 239Q2a0JZCV
Name 2-(4-Thioureidobenzamido)acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11N3O3S
InChI InChI=1S/C10H11N3O3S/c11-10(17)13-7-3-1-6(2-4-7)9(16)12-5-8(14)15/h1-4H,5H2,(H,12,16)(H,14,15)(H3,11,13,17)
InChIKey STRSFHNACPMLMQ-UHFFFAOYSA-N
Molecular Weight 253.276 g/mol
SMILES N(C(=S)N)c1ccc(C(NCC(=O)O)=O)cc1
SPLASH splash10-03di-9510000000-863a5c29f4b6b2ae35ac
Source of Spectrum EMC-64-117-2
Synonyms 2-[[[4-(carbamothioylamino)phenyl]-oxomethyl]amino]acetic acid 2-[[4-(carbamothioylamino)benzoyl]amino]acetic acid 2-[[4-(carbamothioylamino)phenyl]carbonylamino]ethanoic acid
Wiley ID 1735545