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N-Carbamoyl-N'-p-methoxybenzoyl-S-methylisothiourea
SpectraBase Compound ID IJYRLwfPR3S
InChI InChI=1S/C11H13N3O3S/c1-17-8-5-3-7(4-6-8)9(15)13-11(18-2)14-10(12)16/h3-6H,1-2H3,(H3,12,13,14,15,16)
InChIKey APPBDNBVQAFURF-UHFFFAOYSA-N
Mol Weight 267.3 g/mol
Molecular Formula C11H13N3O3S
Exact Mass 267.067762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID At6Whxl6la2
Name N-Carbamoyl-N'-p-methoxybenzoyl-S-methylisothiourea
Alternate Name(s) Methyl N'-[(Z)-amino(oxo)methyl]-N-(4-methoxybenzoyl)imidothiocarbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13N3O3S
InChI InChI=1S/C11H13N3O3S/c1-17-8-5-3-7(4-6-8)9(15)13-11(18-2)14-10(12)16/h3-6H,1-2H3,(H3,12,13,14,15,16)
InChIKey APPBDNBVQAFURF-UHFFFAOYSA-N
Molecular Weight 267.303 g/mol
SMILES N(\C(=N\C(=O)N)SC)C(c1ccc(cc1)OC)=O
SPLASH splash10-000i-0920000000-ea262980a619a450bfc5
Source of Spectrum H1-43-843-3
Wiley ID 758069