| SpectraBase Spectrum ID |
A5aqCrSVZ5D |
| Name |
8-azabicyclo[3.2.1]octan-3-one, 2,4-bis[[3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl]methylene]-8-methyl-, (2E,4E)- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
591.320940197 u |
| Formula |
C36H41N5O3 |
| InChI |
InChI=1S/C36H41N5O3/c1-22-14-24(3)40(37-22)20-28-16-26(8-12-34(28)43-6)18-30-32-10-11-33(39(32)5)31(36(30)42)19-27-9-13-35(44-7)29(17-27)21-41-25(4)15-23(2)38-41/h8-9,12-19,32-33H,10-11,20-21H2,1-7H3/b30-18+,31-19+/t32-,33?/m0/s1 |
| InChIKey |
DDPSIDDSXIKGOY-FXQXAIKJSA-N |
| Molecular Weight |
591.756 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_6255 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13289408 |
![8-azabicyclo[3.2.1]octan-3-one, 2,4-bis[[3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl]methylene]-8-methyl-, (2E,4E)-](/api/spectrum/A5aqCrSVZ5D/structure.png?h=300&w=458 "8-azabicyclo[3.2.1]octan-3-one, 2,4-bis[[3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl]methylene]-8-methyl-, (2E,4E)-")
