| SpectraBase Spectrum ID |
4N7eCltfj2Y |
| Name |
1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one, 1-(2-benzothiazolyl)-4,8-dihydro-3-methyl-4-[3-(trifluoromethyl)phenyl]- |
| 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/C21H15F3N4OS2/c1-11-17-18(12-5-4-6-13(9-12)21(22,23)24)30-10-16(29)26-19(17)28(27-11)20-25-14-7-2-3-8-15(14)31-20/h2-9,18H,10H2,1H3,(H,26,29) |
| InChIKey |
ZIRQTKLOIJVEET-UHFFFAOYSA-N |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Origin |
1H_ASIOH_7529_3607 |
| 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/17231330; Labnumber: DUD-7030128 |
![1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one, 1-(2-benzothiazolyl)-4,8-dihydro-3-methyl-4-[3-(trifluoromethyl)phenyl]-](/api/spectrum/4N7eCltfj2Y/structure.png?h=300&w=458 "1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one, 1-(2-benzothiazolyl)-4,8-dihydro-3-methyl-4-[3-(trifluoromethyl)phenyl]-")
