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(E)-2-(Hydroxyimino)-6,6-dimethyl-3-(4-(methylthio) phenyl)-2,3,6,7-tetrahydrobenzofuran-4(5H)-one
SpectraBase Compound ID 6kyyFletoDl
InChI InChI=1S/C17H19NO3S/c1-17(2)8-12(19)15-13(9-17)21-16(18-20)14(15)10-4-6-11(22-3)7-5-10/h4-7,14,20H,8-9H2,1-3H3/b18-16+
InChIKey JGZRNZRFGKTIAO-FBMGVBCBSA-N
Mol Weight 317.4 g/mol
Molecular Formula C17H19NO3S
Exact Mass 317.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ELdpHkayqxU
Name (E)-2-(Hydroxyimino)-6,6-dimethyl-3-(4-(methylthio) phenyl)-2,3,6,7-tetrahydrobenzofuran-4(5H)-one
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Formula C17H19NO3S
InChI InChI=1S/C17H19NO3S/c1-17(2)8-12(19)15-13(9-17)21-16(18-20)14(15)10-4-6-11(22-3)7-5-10/h4-7,14,20H,8-9H2,1-3H3/b18-16+
InChIKey JGZRNZRFGKTIAO-FBMGVBCBSA-N
Molecular Weight 317.403 g/mol
SMILES O\N=C/1C(C2=C(O1)CC(CC2=O)(C)C)c1ccc(cc1)SC
SPLASH splash10-014i-0019000000-424e24a5788863e9e179
Source of Spectrum F-66-3758-6a
Wiley ID 1685432