SpectraBase Spectrum ID |
BpVxjZgLzWb |
Name |
2-{[4-allyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methoxyphenyl)ethanone |
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/C21H21N3O3S/c1-3-13-24-20(14-27-18-7-5-4-6-8-18)22-23-21(24)28-15-19(25)16-9-11-17(26-2)12-10-16/h3-12H,1,13-15H2,2H3 |
InChIKey |
NMSPECUMIPMVLI-UHFFFAOYSA-N |
NMR Offset |
15.3537 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_UBI_21270_16499 |
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: UZI/8125894; UBI_ID: UBI-016502 |
Temperature |
308 °C |