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diethylthiocarbamic acid, O-(p-nitrophenyl)ester
SpectraBase Compound ID 1WqtQWJLWLM
InChI InChI=1S/C11H14N2O3S/c1-3-12(4-2)11(17)16-10-7-5-9(6-8-10)13(14)15/h5-8H,3-4H2,1-2H3
InChIKey KQOULKVCPZQYBD-UHFFFAOYSA-N
Mol Weight 254.3 g/mol
Molecular Formula C11H14N2O3S
Exact Mass 254.072513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YXiXtzvBAd
Name N,N-diethylcarbamothioic acid O-(4-nitrophenyl) ester
CAS Registry Number 4635-24-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14N2O3S
InChI InChI=1S/C11H14N2O3S/c1-3-12(4-2)11(17)16-10-7-5-9(6-8-10)13(14)15/h5-8H,3-4H2,1-2H3
InChIKey KQOULKVCPZQYBD-UHFFFAOYSA-N
Molecular Weight 254.304 g/mol
SMILES CCN(C(Oc1ccc(N(=O)=O)cc1)=S)CC
SPLASH splash10-0uk9-9600000000-612b568982a79b5e3c63
Source of Spectrum AD-0-2532-0
Synonyms N,N-diethylthiocarbamic acid O-(4-nitrophenyl) ester O-(4-nitrophenyl) N,N-diethylcarbamothioate
Wiley ID 1428712