SpectraBase Spectrum ID |
LqfX8okdLOG |
Name |
3-[2-(1-cyclohexen-1-yl)ethyl]-7-{[4-(2-pyridinyl)-1-piperazinyl]carbonyl}-2,4(1H,3H)-quinazolinedione |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
459.227039811 u |
Formula |
C26H29N5O3 |
InChI |
InChI=1S/C26H29N5O3/c32-24(30-16-14-29(15-17-30)23-8-4-5-12-27-23)20-9-10-21-22(18-20)28-26(34)31(25(21)33)13-11-19-6-2-1-3-7-19/h4-6,8-10,12,18H,1-3,7,11,13-17H2,(H,28,34) |
InChIKey |
KVDOGPNKWBYWSP-UHFFFAOYSA-N |
Molecular Weight |
459.550 g/mol |
NMR Offset |
17.9979 |
NMR Spectrometer Frequency |
500.136 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_9797 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13229843 |