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Metamizole
SpectraBase Compound ID 3wEL4xS9bL3
InChI InChI=1S/C13H17N3O4S/c1-10-12(14(2)9-21(18,19)20)13(17)16(15(10)3)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3,(H,18,19,20)
InChIKey LVWZTYCIRDMTEY-UHFFFAOYSA-N
Mol Weight 311.36 g/mol
Molecular Formula C13H17N3O4S
Exact Mass 311.093977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wRaa58v6Rn
Name METHANESULFONIC ACID, [(2,3-DIHYDRO-1,5-DIMETHYL-3-OXO-2-PHENYL-1H-PYRAZOL-4-YL)METHYLAMINO]-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H17N3O4S
InChI InChI=1S/C13H17N3O4S/c1-10-12(14(2)9-21(18,19)20)13(17)16(15(10)3)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3,(H,18,19,20)
InChIKey LVWZTYCIRDMTEY-UHFFFAOYSA-N
Instrument Name 311A
Molecular Weight 311.0936
SMILES OS(=O)(=O)CN(C)C=1C(N(c2ccccc2)N(C1C)C)=O
SPLASH splash10-0a4i-9110000000-a3ccd3140ef48aaf4fb7
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany