| SpectraBase Spectrum ID |
4gMJ5j9V0ah |
| Name |
1-(1,3-benzodioxol-5-ylmethyl)-4-[4-(trifluoromethyl)benzyl]piperazinediium oxalate |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C20H21F3N2O2.C2H2O4/c21-20(22,23)17-4-1-15(2-5-17)12-24-7-9-25(10-8-24)13-16-3-6-18-19(11-16)27-14-26-18;3-1(4)2(5)6/h1-6,11H,7-10,12-14H2;(H,3,4)(H,5,6) |
| InChIKey |
OXRWDKCBMQVNNA-UHFFFAOYSA-N |
| NMR Offset |
16.0772 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UBI_21270_8434 |
| 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/9030422; UBI_ID: UBI-008437 |
| Temperature |
313 °C |
![1-(1,3-benzodioxol-5-ylmethyl)-4-[4-(trifluoromethyl)benzyl]piperazinediium oxalate](/api/spectrum/4gMJ5j9V0ah/structure.png?h=300&w=458 "1-(1,3-benzodioxol-5-ylmethyl)-4-[4-(trifluoromethyl)benzyl]piperazinediium oxalate")
