| SpectraBase Spectrum ID |
4LNefrcpXSe |
| Name |
piperazinium, 1-[2-[(4-methoxy-1,2,5-oxadiazol-3-yl)oxy]ethyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]-, chloride |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
453.102680916 u |
| Formula |
C16H19ClF3N5O5 |
| InChI |
InChI=1S/C16H18F3N5O5.ClH/c1-27-14-15(21-29-20-14)28-9-8-22-4-6-23(7-5-22)12-3-2-11(16(17,18)19)10-13(12)24(25)26;/h2-3,10H,4-9H2,1H3;1H |
| InChIKey |
XWOVVMJNFXYMIT-UHFFFAOYSA-N |
| Molecular Weight |
453.806 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_3558 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9243531; Lab Info: LP; Lab Number: LP-2500908 |
| Temperature |
29.85 °C |
![piperazinium, 1-[2-[(4-methoxy-1,2,5-oxadiazol-3-yl)oxy]ethyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]-, chloride](/api/spectrum/4LNefrcpXSe/structure.png?h=300&w=458 "piperazinium, 1-[2-[(4-methoxy-1,2,5-oxadiazol-3-yl)oxy]ethyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]-, chloride")
