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N-(tert-Butyloxycarbonyl)-2-[(E)-2-(p-toluenesulfonyl)ethenyl]indoline
SpectraBase Compound ID 8YXQ4T2nHQs
InChI InChI=1S/C22H25NO4S/c1-16-9-11-19(12-10-16)28(25,26)14-13-18-15-17-7-5-6-8-20(17)23(18)21(24)27-22(2,3)4/h5-14,18H,15H2,1-4H3/b14-13+
InChIKey QAQKDCRLWGVWDH-BUHFOSPRSA-N
Mol Weight 399.51 g/mol
Molecular Formula C22H25NO4S
Exact Mass 399.150429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Pq3gw0Xht9
Name N-(tert-Butyloxycarbonyl)-2-[(E)-2-(p-toluenesulfonyl)ethenyl]indoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25NO4S
InChI InChI=1S/C22H25NO4S/c1-16-9-11-19(12-10-16)28(25,26)14-13-18-15-17-7-5-6-8-20(17)23(18)21(24)27-22(2,3)4/h5-14,18H,15H2,1-4H3/b14-13+
InChIKey QAQKDCRLWGVWDH-BUHFOSPRSA-N
Molecular Weight 399.505 g/mol
SMILES C1(N(c2ccccc2C1)C(=O)OC(C)(C)C)\C=C\S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-0006-0902000000-1bc4b044043bf81c7770
Source of Spectrum J-66-8603-3
Synonyms tert-Butyl 2-{(E)-2-[(4-methylphenyl)sulfonyl]ethenyl}-1-indolinecarboxylate 2-[(E)-2-(4-methylphenyl)sulfonylethenyl]-2,3-dihydroindole-1-carboxylic acid tert-butyl ester tert-Butyl 2-[(E)-2-(p-tolylsulfonyl)vinyl]indoline-1-carboxylate tert-Butyl 2-[(E)-2-(4-methylphenyl)sulfonylethenyl]-2,3-dihydroindole-1-carboxylate
Wiley ID 1568646