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N-[(1S)-2-azido-1-(6-bromo-1-tosyl-indol-3-yl)ethyl]carbamic acid tert-butyl ester
SpectraBase Compound ID 6fzFUBjHO89
InChI InChI=1S/C22H24BrN5O4S/c1-14-5-8-16(9-6-14)33(30,31)28-13-18(17-10-7-15(23)11-20(17)28)19(12-25-27-24)26-21(29)32-22(2,3)4/h5-11,13,19H,12H2,1-4H3,(H,26,29)/t19-/m1/s1
InChIKey LVYINKVYZQEOJS-LJQANCHMSA-N
Mol Weight 534.43 g/mol
Molecular Formula C22H24BrN5O4S
Exact Mass 533.073238 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2y3E7DGA1g
Name N-[(1S)-2-azido-1-(6-bromo-1-tosyl-indol-3-yl)ethyl]carbamic acid tert-butyl ester
Alternate Name(s) N-[(1S)-2-azido-1-[6-bromo-1-(4-methylphenyl)sulfonyl-3-indolyl]ethyl]carbamic acid tert-butyl ester tert-Butyl N-[(1S)-2-azido-1-[6-bromanyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]ethyl]carbamate tert-Butyl N-[(1S)-2-azido-1-[6-bromo-1-(4-methylphenyl)sulfonylindol-3-yl]ethyl]carbamate tert-Butyl N-[(1S)-2-azido-1-[6-bromo-1-(p-tolylsulfonyl)indol-3-yl]ethyl]carbamate
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Formula C22H24BrN5O4S
InChI InChI=1S/C22H24BrN5O4S/c1-14-5-8-16(9-6-14)33(30,31)28-13-18(17-10-7-15(23)11-20(17)28)19(12-25-27-24)26-21(29)32-22(2,3)4/h5-11,13,19H,12H2,1-4H3,(H,26,29)/t19-/m1/s1
InChIKey LVYINKVYZQEOJS-LJQANCHMSA-N
Molecular Weight 534.429 g/mol
SMILES N(C(OC(C)(C)C)=O)[C@@](c1c[n](S(c2ccc(cc2)C)(=O)=O)c2c1ccc(c2)Br)(CN=[N+]=[N-])[H]
SPLASH splash10-05i0-5102900000-4ce5b66acabfd6bd6cbc
Source of Spectrum KC-61-2315-14
Wiley ID 1628043