For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(5E)-3-(Hydroxymethyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-oxazolidin-4-one
SpectraBase Compound ID GIbDMbJRaiC
InChI InChI=1S/C11H8N2O5S/c14-6-12-10(15)9(18-11(12)19)5-7-1-3-8(4-2-7)13(16)17/h1-5,14H,6H2/b9-5+
InChIKey NEWWHPXDAQRCRX-WEVVVXLNSA-N
Mol Weight 280.25 g/mol
Molecular Formula C11H8N2O5S
Exact Mass 280.015393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9xVIELKQSLj
Name (5E)-3-(Hydroxymethyl)-5-(4-nitrobenzylidene)-2-thioxo-1,3-oxazolidin-4-one
CAS Registry Number 122975-81-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8N2O5S
InChI InChI=1S/C11H8N2O5S/c14-6-12-10(15)9(18-11(12)19)5-7-1-3-8(4-2-7)13(16)17/h1-5,14H,6H2/b9-5+
InChIKey NEWWHPXDAQRCRX-WEVVVXLNSA-N
Molecular Weight 280.254 g/mol
SMILES OCN1C(O\C(C1=O)=C/c1ccc(N(=O)=O)cc1)=S
SPLASH splash10-03dr-9510000000-8889b72bb8ddd24b7f51
Source of Spectrum AD-0-2532-0
Synonyms (5E)-3-(hydroxymethyl)-5-[(4-nitrophenyl)methylene]-2-thioxo-oxazolidin-4-one (5E)-3-(hydroxymethyl)-5-[(4-nitrophenyl)methylidene]-2-sulfanylidene-1,3-oxazolidin-4-one (5E)-3-(hydroxymethyl)-5-[(4-nitrophenyl)methylidene]-2-sulfanylidene-4-oxazolidinone (5E)-3-methylol-5-(4-nitrobenzylidene)-2-thioxo-oxazolidin-4-one Oxazolidin-4-one, 3-hydroxymethyl-5-(4-nitrobenzylideno)-2-thioxo-
Wiley ID 1425634