SpectraBase Spectrum ID |
LmHXO3ERGov |
Name |
3H-cyclopenta[c]quinoline, 4-(3-bromo-4-ethoxy-5-methoxyphenyl)-3a,4,5,9b-tetrahydro-8-nitro- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
444.068470160 u |
Formula |
C21H21BrN2O4 |
InChI |
InChI=1S/C21H21BrN2O4/c1-3-28-21-17(22)9-12(10-19(21)27-2)20-15-6-4-5-14(15)16-11-13(24(25)26)7-8-18(16)23-20/h4-5,7-11,14-15,20,23H,3,6H2,1-2H3 |
InChIKey |
PRULTHQJMVFROH-UHFFFAOYSA-N |
Molecular Weight |
445.313 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_8543 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10210178; Lab Info: LP; Lab Number: LP-0400209 |