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3-[2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-acetylamino]-4-sulfonylhydrazide-butyric acid benzyl ester
SpectraBase Compound ID HnJu5KaP74n
InChI InChI=1S/C21H22N4O7S/c22-24-33(30,31)13-15(10-19(27)32-12-14-6-2-1-3-7-14)23-18(26)11-25-20(28)16-8-4-5-9-17(16)21(25)29/h1-9,15,24H,10-13,22H2,(H,23,26)
InChIKey LBXIGJFDIJSGJY-UHFFFAOYSA-N
Mol Weight 474.49 g/mol
Molecular Formula C21H22N4O7S
Exact Mass 474.12092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FFf30IcEZ1F
Name 3-[2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-acetylamino]-4-sulfonylhydrazide-butyric acid benzyl ester
Alternate Name(s) benzyl 3-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl]amino}-4-(hydrazinosulfonyl)butanoate Benzyl[4'-(hydrazinosulfonyl)-2'-(phthaloylglycyl)-1',2'-thiazetidin-3'-yl]-acetate-1,1-Dioxide 3-[[2-(1,3-dioxo-2-isoindolyl)-1-oxoethyl]amino]-4-(hydrazinesulfonyl)butanoic acid (phenylmethyl) ester benzyl 3-[[2-(1,3-dioxoisoindol-2-yl)acetyl]amino]-4-(hydrazinesulfonyl)butanoate benzyl 3-[[2-(1,3-dioxoisoindolin-2-yl)acetyl]amino]-4-(hydrazinesulfonyl)butanoate (phenylmethyl) 4-(aminosulfamoyl)-3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylamino]butanoate
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Formula C21H22N4O7S
InChI InChI=1S/C21H22N4O7S/c22-24-33(30,31)13-15(10-19(27)32-12-14-6-2-1-3-7-14)23-18(26)11-25-20(28)16-8-4-5-9-17(16)21(25)29/h1-9,15,24H,10-13,22H2,(H,23,26)
InChIKey LBXIGJFDIJSGJY-UHFFFAOYSA-N
Molecular Weight 474.488 g/mol
SMILES N(C(CS(NN)(=O)=O)CC(=O)OCc1ccccc1)C(CN1C(c2ccccc2C1=O)=O)=O
SPLASH splash10-0xvo-9900000000-64d29c646979ddfeed28
Source of Spectrum AH-135-64-10
Wiley ID 1576342