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2H-Pyran-2-one, 3-[1-(ethoxyimino)ethyl]-4-hydroxy-6-[(phenylthio)methyl]-
SpectraBase Compound ID IyJVmYDrRDf
InChI InChI=1S/C16H17NO4S/c1-3-20-17-11(2)15-14(18)9-12(21-16(15)19)10-22-13-7-5-4-6-8-13/h4-9,18H,3,10H2,1-2H3/b17-11+
InChIKey PJRCYKZYTNARMA-GZTJUZNOSA-N
Mol Weight 319.38 g/mol
Molecular Formula C16H17NO4S
Exact Mass 319.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FxGtwPFyRKD
Name 2H-Pyran-2-one, 3-[1-(ethoxyimino)ethyl]-4-hydroxy-6-[(phenylthio)methyl]-
CAS Registry Number 126759-75-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO4S
InChI InChI=1S/C16H17NO4S/c1-3-20-17-11(2)15-14(18)9-12(21-16(15)19)10-22-13-7-5-4-6-8-13/h4-9,18H,3,10H2,1-2H3/b17-11+
InChIKey PJRCYKZYTNARMA-GZTJUZNOSA-N
Molecular Weight 319.375 g/mol
SMILES OC1=C(C(OC(=C1)CSc1ccccc1)=O)\C(=N\OCC)C
SPLASH splash10-0gea-1902000000-36cd667e53cb60532f8d
Source of Spectrum Y-26-1211-40
Synonyms 3-[(1E)-N-ethoxyethanimidoyl]-4-hydroxy-6-[(phenylsulfanyl)methyl]-2H-pyran-2-one 3-[1-(ethyloxyimino)ethyl]-4-hydroxy-6-phenylthiomethyl-2-pyrone
Wiley ID 1319252