| SpectraBase Spectrum ID |
HlcU2wqWG0j |
| Name |
1-piperazinecarbothioamide, N-[2-chloro-5-(trifluoromethyl)phenyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
512.050843589 u |
| Formula |
C19H15ClF6N4O2S |
| InChI |
InChI=1S/C19H15ClF6N4O2S/c20-13-3-1-11(18(21,22)23)9-14(13)27-17(33)29-7-5-28(6-8-29)15-4-2-12(19(24,25)26)10-16(15)30(31)32/h1-4,9-10H,5-8H2,(H,27,33) |
| InChIKey |
XSMHEQLRUOPJJF-UHFFFAOYSA-N |
| Molecular Weight |
512.858 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_15956 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10301723; Lab Info: SIP; Lab Number: SIP-123 |
![N-[2-chloro-5-(trifluoromethyl)phenyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinecarbothioamide](/api/spectrum/HlcU2wqWG0j/structure.png?h=300&w=458 "N-[2-chloro-5-(trifluoromethyl)phenyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinecarbothioamide")
