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5-Diethylamido-1-tosyl-3H-1,2,4,5-tetrahydroindole

View entire compound with spectra: 1 MS (GC)

5-Diethylamido-1-tosyl-3H-1,2,4,5-tetrahydroindole
SpectraBase Compound ID 3W7AqlidqCq
InChI InChI=1S/C20H28N2O3S/c1-4-21(5-2)20(23)17-8-11-19-16(14-17)12-13-22(19)26(24,25)18-9-6-15(3)7-10-18/h6-11,16-17,19H,4-5,12-14H2,1-3H3/t16-,17+,19+/m1/s1
InChIKey MRVWKAUCJAEYJB-AOIWGVFYSA-N
Mol Weight 376.52 g/mol
Molecular Formula C20H28N2O3S
Exact Mass 376.182064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IbWTOXK3XoF
Name 5-Diethylamido-1-tosyl-3H-1,2,4,5-tetrahydroindole
Alternate Name(s) (3aS,5R,7aR)-1-(Toluene-4-sulfonyl)-2,3,3a,4,5,7a-hexahydro-1H-indole-5-carboxylic acid diethylamide (3aS,5R,7aR)-N,N-diethyl-1-(p-tolylsulfonyl)-2,3,3a,4,5,7a-hexahydroindole-5-carboxamide (3aS,5R,7aR)-N,N-diethyl-1-(4-methylphenyl)sulfonyl-2,3,3a,4,5,7a-hexahydroindole-5-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28N2O3S
InChI InChI=1S/C20H28N2O3S/c1-4-21(5-2)20(23)17-8-11-19-16(14-17)12-13-22(19)26(24,25)18-9-6-15(3)7-10-18/h6-11,16-17,19H,4-5,12-14H2,1-3H3/t16-,17+,19+/m1/s1
InChIKey MRVWKAUCJAEYJB-AOIWGVFYSA-N
Molecular Weight 376.515 g/mol
SMILES [C@@]12(N(S(c3ccc(cc3)C)(=O)=O)CC[C@@]2(C[C@](C=C1)(C(N(CC)CC)=O)[H])[H])[H]
SPLASH splash10-00dl-9740000000-795a4dd10f21a00734d9
Source of Spectrum AT-35-4444-7
Wiley ID 852765