SpectraBase Spectrum ID |
AIn9SaeDj5i |
Name |
2-{[4-allyl-5-(4-tert-butylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3-benzodioxol-5-yl)acetamide |
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/C24H26N4O3S/c1-5-12-28-22(16-6-8-17(9-7-16)24(2,3)4)26-27-23(28)32-14-21(29)25-18-10-11-19-20(13-18)31-15-30-19/h5-11,13H,1,12,14-15H2,2-4H3,(H,25,29) |
InChIKey |
HZEBKMLBILBVQH-UHFFFAOYSA-N |
NMR Offset |
15.5012 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_SBI_36227_4474 |
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: D99007; Labnumber: GRES-29994; SBI_ID: SBI-004476 |
Temperature |
315 °C |