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2H-Pyran-2-one, 4-hydroxy-6-[(phenylthio)methyl]-3-[1-[(2-propenyloxy)imino]ethyl]-
SpectraBase Compound ID 9BhRwPkEdzT
InChI InChI=1S/C17H17NO4S/c1-3-9-21-18-12(2)16-15(19)10-13(22-17(16)20)11-23-14-7-5-4-6-8-14/h3-8,10,19H,1,9,11H2,2H3/b18-12+
InChIKey OCHPTNIYVQHZJT-LDADJPATSA-N
Mol Weight 331.39 g/mol
Molecular Formula C17H17NO4S
Exact Mass 331.087829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KywuayVJbKr
Name 2H-Pyran-2-one, 4-hydroxy-6-[(phenylthio)methyl]-3-[1-[(2-propenyloxy)imino]ethyl]-
CAS Registry Number 126759-78-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO4S
InChI InChI=1S/C17H17NO4S/c1-3-9-21-18-12(2)16-15(19)10-13(22-17(16)20)11-23-14-7-5-4-6-8-14/h3-8,10,19H,1,9,11H2,2H3/b18-12+
InChIKey OCHPTNIYVQHZJT-LDADJPATSA-N
Molecular Weight 331.386 g/mol
SMILES OC1=C(C(OC(=C1)CSc1ccccc1)=O)\C(=N\OCC=C)C
SPLASH splash10-069r-2923000000-02886f0dc405bd34b1b3
Source of Spectrum Y-26-1211-41
Synonyms 3-[(1E)-N-(allyloxy)ethanimidoyl]-4-hydroxy-6-[(phenylsulfanyl)methyl]-2H-pyran-2-one 3-[1-(allyloxyimino)ethyl]-4-hydroxy-6-phenylthiomethyl-2-pyrone
Wiley ID 1328623