For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(S) 4-(2-Hydroxyphenyl)-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepine
SpectraBase Compound ID 9zymUwgTmBf
InChI InChI=1S/C22H19NO2S/c1-25-16-12-10-15(11-13-16)22-14-19(17-6-2-4-8-20(17)24)23-18-7-3-5-9-21(18)26-22/h2-13,22,24H,14H2,1H3/t22-/m0/s1
InChIKey NURKBLZKRNZLHL-QFIPXVFZSA-N
Mol Weight 361.46 g/mol
Molecular Formula C22H19NO2S
Exact Mass 361.11365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID F620s73npXF
Name (S) 4-(2-Hydroxyphenyl)-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H19NO2S
InChI InChI=1S/C22H19NO2S/c1-25-16-12-10-15(11-13-16)22-14-19(17-6-2-4-8-20(17)24)23-18-7-3-5-9-21(18)26-22/h2-13,22,24H,14H2,1H3/t22-/m0/s1
InChIKey NURKBLZKRNZLHL-QFIPXVFZSA-N
Molecular Weight 361.459 g/mol
SMILES Oc1c(C2=Nc3c(cccc3)S[C@@](C2)(c2ccc(cc2)OC)[H])cccc1
SPLASH splash10-005a-0940000000-a29041c506d0c86d4693
Source of Spectrum Y-51-146-13
Synonyms 4-(2-Hydroxyphenyl)-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzothiazepine (S)-2-(2-(4-methoxyphenyl)-2,3-dihydrobenzo[b][1,4]thiazepin-4-yl)phenol
Wiley ID 1741207