SpectraBase Spectrum ID |
oMJe67MrPg |
Name |
piperazinediium, 1-[2-[[4-(chlorodifluoromethoxy)phenyl]amino]-2-oxoethyl]-4-methyl-, dichloride |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
405.058916320 u |
Formula |
C14H20Cl3F2N3O2 |
InChI |
InChI=1S/C14H18ClF2N3O2.2ClH/c1-19-6-8-20(9-7-19)10-13(21)18-11-2-4-12(5-3-11)22-14(15,16)17;;/h2-5H,6-10H2,1H3,(H,18,21);2*1H |
InChIKey |
LGXQGVJMHGIBDC-UHFFFAOYSA-N |
Molecular Weight |
406.689 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_17565 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/11240536; Lab Info: JMR; Lab Number: JMR-0000083 |