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3-[3-(tosylamino)prop-1-ynyl]indole-1-carboxylic acid tert-butyl ester
SpectraBase Compound ID Ii74KkeZ61a
InChI InChI=1S/C23H24N2O4S/c1-17-11-13-19(14-12-17)30(27,28)24-15-7-8-18-16-25(22(26)29-23(2,3)4)21-10-6-5-9-20(18)21/h5-6,9-14,16,24H,15H2,1-4H3
InChIKey NMVZHAWMKJDDQD-UHFFFAOYSA-N
Mol Weight 424.52 g/mol
Molecular Formula C23H24N2O4S
Exact Mass 424.145678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GErWPE5qR3q
Name 3-[3-(tosylamino)prop-1-ynyl]indole-1-carboxylic acid tert-butyl ester
Alternate Name(s) 3-[3-[(4-methylphenyl)sulfonylamino]prop-1-ynyl]-1-indolecarboxylic acid tert-butyl ester tert-Butyl 3-[3-(p-tolylsulfonylamino)prop-1-ynyl]indole-1-carboxylate tert-Butyl 3-[3-[(4-methylphenyl)sulfonylamino]prop-1-ynyl]indole-1-carboxylate
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Formula C23H24N2O4S
InChI InChI=1S/C23H24N2O4S/c1-17-11-13-19(14-12-17)30(27,28)24-15-7-8-18-16-25(22(26)29-23(2,3)4)21-10-6-5-9-20(18)21/h5-6,9-14,16,24H,15H2,1-4H3
InChIKey NMVZHAWMKJDDQD-UHFFFAOYSA-N
Molecular Weight 424.515 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)CC#Cc1c[n](C(OC(C)(C)C)=O)c2c1cccc2
SPLASH splash10-014l-3921000000-dda9abfd873078896d3e
Source of Spectrum C5-2005-774-4
Wiley ID 1618184