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4-Oxopentanoic acid, p-tolylsulfonylhydrazone, ethyl ester
SpectraBase Compound ID LXe9KoeS3uL
InChI InChI=1S/C14H20N2O4S/c1-4-20-14(17)10-7-12(3)15-16-21(18,19)13-8-5-11(2)6-9-13/h5-6,8-9,16H,4,7,10H2,1-3H3/b15-12+
InChIKey IIPNNDGAHZQWGI-NTCAYCPXSA-N
Mol Weight 312.38 g/mol
Molecular Formula C14H20N2O4S
Exact Mass 312.114378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AwHWRAHRFQ2
Name 4-Oxopentanoic acid, p-tolylsulfonylhydrazone, ethyl ester
Alternate Name(s) (4E)-4-(tosylhydrazono)valeric acid ethyl ester (4E)-4-[(4-methylphenyl)sulfonylhydrazinylidene]pentanoic acid ethyl ester Ethyl (4E)-4-(p-tolylsulfonylhydrazono)pentanoate Ethyl (4E)-4-[(4-methylphenyl)sulfonylhydrazinylidene]pentanoate
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Formula C14H20N2O4S
InChI InChI=1S/C14H20N2O4S/c1-4-20-14(17)10-7-12(3)15-16-21(18,19)13-8-5-11(2)6-9-13/h5-6,8-9,16H,4,7,10H2,1-3H3/b15-12+
InChIKey IIPNNDGAHZQWGI-NTCAYCPXSA-N
Molecular Weight 312.384 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)\N=C/(C)CCC(=O)OCC
SPLASH splash10-0a6v-9310000000-f91733e255d1a40acb73
Wiley ID 1479400