SpectraBase Spectrum ID |
G6bob2D2fSx |
Name |
piperazine, 1-(2-chloro-4,5-difluorobenzoyl)-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 |
449.056559803 u |
Formula |
C18H13ClF5N3O3 |
InChI |
InChI=1S/C18H13ClF5N3O3/c19-12-9-14(21)13(20)8-11(12)17(28)26-5-3-25(4-6-26)15-2-1-10(18(22,23)24)7-16(15)27(29)30/h1-2,7-9H,3-6H2 |
InChIKey |
XLADFOPMLFJCTJ-UHFFFAOYSA-N |
Molecular Weight |
449.765 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_4890 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10210089; Lab Info: LP; Lab Number: 25-906 |