SpectraBase Spectrum ID |
ExvTdLRrSiA |
Name |
methanone, [4-(3,4-dihydro-2(1H)-isoquinolinyl)-3-nitrophenyl](4-nitrophenyl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
403.116820654 u |
Formula |
C22H17N3O5 |
InChI |
InChI=1S/C22H17N3O5/c26-22(16-5-8-19(9-6-16)24(27)28)17-7-10-20(21(13-17)25(29)30)23-12-11-15-3-1-2-4-18(15)14-23/h1-10,13H,11-12,14H2 |
InChIKey |
BEENUDKRPYAKMY-UHFFFAOYSA-N |
Molecular Weight |
403.394 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_8111 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9301620; Lab Info: AI; Lab Number: AI-S000996 |
Temperature |
29.85 °C |