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3-(naphthalen-1-yl)-5,7-diphenyl-1-tosyl-2,3-dihydro-1H-azepine
SpectraBase Compound ID HjbbfA95AVL
InChI InChI=1S/C35H29NO2S/c1-26-19-21-32(22-20-26)39(37,38)36-25-31(34-18-10-16-28-13-8-9-17-33(28)34)23-30(27-11-4-2-5-12-27)24-35(36)29-14-6-3-7-15-29/h2-24,31H,25H2,1H3
InChIKey ZZGNCHXLJQTNDV-UHFFFAOYSA-N
Mol Weight 527.7 g/mol
Molecular Formula C35H29NO2S
Exact Mass 527.1919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3QhR2Wi2Hw
Name 3-(naphthalen-1-yl)-5,7-diphenyl-1-tosyl-2,3-dihydro-1H-azepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H29NO2S
InChI InChI=1S/C35H29NO2S/c1-26-19-21-32(22-20-26)39(37,38)36-25-31(34-18-10-16-28-13-8-9-17-33(28)34)23-30(27-11-4-2-5-12-27)24-35(36)29-14-6-3-7-15-29/h2-24,31H,25H2,1H3
InChIKey ZZGNCHXLJQTNDV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201304902
Molecular Weight 527.682 g/mol
SMILES C1N(C(c2ccccc2)=CC(c2ccccc2)=CC1c1cccc2c1cccc2)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-00dl-2309020000-1d93f4e574ae04d2a686
Source of Spectrum ACI-52-SM-21
Wiley ID 1781800