SpectraBase Spectrum ID |
5PweNXCylex |
Name |
1H-pyrido[3,4-b]indole, 1-(1,3-benzodioxol-5-yl)-2,3,4,9-tetrahydro-2-(4-methylbenzoyl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
410.163042573 u |
Formula |
C26H22N2O3 |
InChI |
InChI=1S/C26H22N2O3/c1-16-6-8-17(9-7-16)26(29)28-13-12-20-19-4-2-3-5-21(19)27-24(20)25(28)18-10-11-22-23(14-18)31-15-30-22/h2-11,14,25,27H,12-13,15H2,1H3 |
InChIKey |
CJLQQHJFIKBSNX-UHFFFAOYSA-N |
Molecular Weight |
410.473 g/mol |
NMR Offset |
15.0036 |
NMR Spectrometer Frequency |
250.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_1378 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/8010808; Lab Info: AGAF; Lab Number: AGAF-0000087 |
Temperature |
23.85 °C |