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3-Phenyl-5,7-di-m-tolyl-1-tosyl-2,3-dihydro-1H-azepine
SpectraBase Compound ID 7OwTmpLJJA4
InChI InChI=1S/C33H31NO2S/c1-24-15-17-32(18-16-24)37(35,36)34-23-31(27-11-5-4-6-12-27)21-30(28-13-7-9-25(2)19-28)22-33(34)29-14-8-10-26(3)20-29/h4-22,31H,23H2,1-3H3
InChIKey QQIKYWQQTOJUKV-UHFFFAOYSA-N
Mol Weight 505.7 g/mol
Molecular Formula C33H31NO2S
Exact Mass 505.20755 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ESIjhG2NQml
Name 3-Phenyl-5,7-di-m-tolyl-1-tosyl-2,3-dihydro-1H-azepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H31NO2S
InChI InChI=1S/C33H31NO2S/c1-24-15-17-32(18-16-24)37(35,36)34-23-31(27-11-5-4-6-12-27)21-30(28-13-7-9-25(2)19-28)22-33(34)29-14-8-10-26(3)20-29/h4-22,31H,23H2,1-3H3
InChIKey QQIKYWQQTOJUKV-UHFFFAOYSA-N
Molecular Weight 505.676 g/mol
SMILES c1c(cc(cc1)C)C=1C=C(c2cc(C)ccc2)N(S(c2ccc(cc2)C)(=O)=O)CC(C1)c1ccccc1
SPLASH splash10-0udi-3009000000-8cd8760f09c340d72286
Source of Spectrum ACI-53-SM-7
Wiley ID 1782163