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

*Links on SpectraBase are not permalinks.
1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one, 4-[4-[(4-chlorophenyl)methoxy]phenyl]-4,8-dihydro-1-(6-methoxy-2-benzothiazolyl)-3-methyl-
SpectraBase Compound ID 6xpndyq9GTI
InChI InChI=1S/C28H23ClN4O3S2/c1-16-25-26(18-5-9-20(10-6-18)36-14-17-3-7-19(29)8-4-17)37-15-24(34)31-27(25)33(32-16)28-30-22-12-11-21(35-2)13-23(22)38-28/h3-13,26H,14-15H2,1-2H3,(H,31,34)
InChIKey FOCXUNPHEXCLSO-UHFFFAOYSA-N
Mol Weight 563.09 g/mol
Molecular Formula C28H23ClN4O3S2
Exact Mass 562.090011 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 97anq7bncEH
Name 1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one, 4-[4-[(4-chlorophenyl)methoxy]phenyl]-4,8-dihydro-1-(6-methoxy-2-benzothiazolyl)-3-methyl-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C28H23ClN4O3S2/c1-16-25-26(18-5-9-20(10-6-18)36-14-17-3-7-19(29)8-4-17)37-15-24(34)31-27(25)33(32-16)28-30-22-12-11-21(35-2)13-23(22)38-28/h3-13,26H,14-15H2,1-2H3,(H,31,34)
InChIKey FOCXUNPHEXCLSO-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_3620
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/17231343; Labnumber: DUD-7030141