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Dimethyl 7-isopropyl-1-phenylsulfonylindole-5,6-dicarboxylate
SpectraBase Compound ID JY6poh3zE1Z
InChI InChI=1S/C21H21NO6S/c1-13(2)17-18(21(24)28-4)16(20(23)27-3)12-14-10-11-22(19(14)17)29(25,26)15-8-6-5-7-9-15/h5-13H,1-4H3
InChIKey KSOZGBVDNWOWDK-UHFFFAOYSA-N
Mol Weight 415.46 g/mol
Molecular Formula C21H21NO6S
Exact Mass 415.108959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BqOTLmvVmiI
Name Dimethyl 7-isopropyl-1-phenylsulfonylindole-5,6-dicarboxylate
Alternate Name(s) Dimethyl 7-isopropyl-1-(phenylsulfonyl)-1H-indole-5,6-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO6S
InChI InChI=1S/C21H21NO6S/c1-13(2)17-18(21(24)28-4)16(20(23)27-3)12-14-10-11-22(19(14)17)29(25,26)15-8-6-5-7-9-15/h5-13H,1-4H3
InChIKey KSOZGBVDNWOWDK-UHFFFAOYSA-N
Molecular Weight 415.460 g/mol
SMILES c1(S([n]2c3c(c(C(=O)OC)c(cc3cc2)C(=O)OC)C(C)C)(=O)=O)ccccc1
SPLASH splash10-0006-4091100000-946b40e5ccb6c42b5796
Source of Spectrum F-48-7459-10
Wiley ID 1375936