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3-(2-Aminothiazol-4-yl)-4-hydroxy-6-methyl-2H-pyran-2-one
SpectraBase Compound ID BDd2sNDnv5L
InChI InChI=1S/C9H8N2O3S/c1-4-2-6(12)7(8(13)14-4)5-3-15-9(10)11-5/h2-3,12H,1H3,(H2,10,11)
InChIKey MZYUUMSXWYEXLE-UHFFFAOYSA-N
Mol Weight 224.23 g/mol
Molecular Formula C9H8N2O3S
Exact Mass 224.025563 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DAvYxX0XRxQ
Name 3-(2-Aminothiazol-4-yl)-4-hydroxy-6-methyl-2H-pyran-2-one
Alternate Name(s) 3-(2-amino-4-thiazolyl)-4-hydroxy-6-methyl-2-pyranone 3-(2-amino-1,3-thiazol-4-yl)-4-hydroxy-6-methylpyran-2-one 3-(2-azanyl-1,3-thiazol-4-yl)-6-methyl-4-oxidanyl-pyran-2-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N2O3S
InChI InChI=1S/C9H8N2O3S/c1-4-2-6(12)7(8(13)14-4)5-3-15-9(10)11-5/h2-3,12H,1H3,(H2,10,11)
InChIKey MZYUUMSXWYEXLE-UHFFFAOYSA-N
Molecular Weight 224.234 g/mol
SMILES Nc1nc(C2=C(C=C(OC2=O)C)O)cs1
SPLASH splash10-004i-0090000000-9655115283b7eaeb5d86
Source of Spectrum Y-48-35-11b
Wiley ID 1667525