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8-Diethylamido-1-tosyl-3H-1,2,4,8-tetrahydroindole
SpectraBase Compound ID J2AvMhUvPpz
InChI InChI=1S/C20H28N2O3S/c1-4-21(5-2)20(23)18-8-6-7-16-13-14-22(19(16)18)26(24,25)17-11-9-15(3)10-12-17/h6,8-12,16,18-19H,4-5,7,13-14H2,1-3H3/t16-,18+,19+/m0/s1
InChIKey BKPMSTSZNUZQFO-QXAKKESOSA-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 9h1KzrL6cCh
Name 8-Diethylamido-1-tosyl-3H-1,2,4,8-tetrahydroindole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28N2O3S
InChI InChI=1S/C20H28N2O3S/c1-4-21(5-2)20(23)18-8-6-7-16-13-14-22(19(16)18)26(24,25)17-11-9-15(3)10-12-17/h6,8-12,16,18-19H,4-5,7,13-14H2,1-3H3/t16-,18+,19+/m0/s1
InChIKey BKPMSTSZNUZQFO-QXAKKESOSA-N
Molecular Weight 376.515 g/mol
SMILES [C@@]12(N(S(c3ccc(C)cc3)(=O)=O)CC[C@@]2(CC=C[C@]1(C(N(CC)CC)=O)[H])[H])[H]
SPLASH splash10-0fdo-9830000000-2fd56fbcceda3653e0c2
Source of Spectrum AT-35-4444-8
Synonyms (3aS,7R,7aR)-N,N-diethyl-1-(p-tolylsulfonyl)-2,3,3a,4,7,7a-hexahydroindole-7-carboxamide (3aS,7R,7aR)-N,N-diethyl-1-(4-methylphenyl)sulfonyl-2,3,3a,4,7,7a-hexahydroindole-7-carboxamide
Wiley ID 852764