SpectraBase Spectrum ID |
Hpq4uqN2JcQ |
Name |
2-{[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]sulfanyl}pyrimidine |
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/C13H11ClN2O2S/c14-11-4-9-6-17-8-18-12(9)10(5-11)7-19-13-15-2-1-3-16-13/h1-5H,6-8H2 |
InChIKey |
MLFFVPTXKUYPNP-UHFFFAOYSA-N |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Origin |
1H_ASIOH_7000_5193 |
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/11211634; Labnumber: LP-2110105; IOH_ID: IOH-005194 |
Synonyms |
(6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-pyrimidinyl sulfide |