SpectraBase Compound ID | 83M8PrvPy3a |
---|---|
InChI | InChI=1S/C8H12N2O5S/c1-6-5-10(8(12)9-7(6)11)3-4-15-16(2,13)14/h5H,3-4H2,1-2H3,(H,9,11,12) |
InChIKey | LWUBOFLJVJMSAS-UHFFFAOYSA-N |
Mol Weight | 248.25 g/mol |
Molecular Formula | C8H12N2O5S |
Exact Mass | 248.046693 g/mol |
SpectraBase Spectrum ID | H5RBn791gT2 |
---|---|
Name | |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C8H12N2O5S |
InChI | InChI=1S/C8H12N2O5S/c1-6-5-10(8(12)9-7(6)11)3-4-15-16(2,13)14/h5H,3-4H2,1-2H3,(H,9,11,12) |
InChIKey | LWUBOFLJVJMSAS-UHFFFAOYSA-N |
Molecular Weight | 248.0464 |
SMILES | N1C(C(=CN(C1=O)CCOS(C)(=O)=O)C)=O |
SPLASH | splash10-0002-9300000000-82bfef5a105a221546d6 |
Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |