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HEXANOIC ACID NITRILE, 3-(DIBENZYLAMINO)-5-METHYL-2-(p-TOSYLAMINO)-
SpectraBase Compound ID 38IJRpLjOcj
InChI InChI=1S/C28H35N3O2S/c1-22(2)18-28(27(19-29)30-34(32,33)26-16-14-23(3)15-17-26)31(20-24-10-6-4-7-11-24)21-25-12-8-5-9-13-25/h4-17,22,27-28,30,32-33H,18,20-21H2,1-3H3
InChIKey HNSDOYQKEGXCQQ-UHFFFAOYSA-N
Mol Weight 477.7 g/mol
Molecular Formula C28H35N3O2S
Exact Mass 477.244999 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1IP5sjaOIIt
Name HEXANOIC ACID NITRILE, 3-(DIBENZYLAMINO)-5-METHYL-2-(p-TOSYLAMINO)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H33N3O2S
InChI InChI=1S/C28H35N3O2S/c1-22(2)18-28(27(19-29)30-34(32,33)26-16-14-23(3)15-17-26)31(20-24-10-6-4-7-11-24)21-25-12-8-5-9-13-25/h4-17,22,27-28,30,32-33H,18,20-21H2,1-3H3
InChIKey HNSDOYQKEGXCQQ-UHFFFAOYSA-N
Instrument Name 311A
Molecular Weight 477.2442
SMILES N(S(O)(c1ccc(C)cc1)O)C(C#N)C(N(Cc1ccccc1)Cc1ccccc1)CC(C)C
SPLASH splash10-014l-9370000000-c0c1c8f73c31ef66e838
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany