SpectraBase Spectrum ID |
CfhlLCA1rGf |
Name |
2-azetidinemethanaminium, 3-(4-chlorophenoxy)-N-cyclopentyl-1-(2-methylphenyl)-4-oxo-, chloride |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
420.137133483 u |
Formula |
C22H26Cl2N2O2 |
InChI |
InChI=1S/C22H25ClN2O2.ClH/c1-15-6-2-5-9-19(15)25-20(14-24-17-7-3-4-8-17)21(22(25)26)27-18-12-10-16(23)11-13-18;/h2,5-6,9-13,17,20-21,24H,3-4,7-8,14H2,1H3;1H |
InChIKey |
BTSGORASQDZNHS-UHFFFAOYSA-N |
Molecular Weight |
421.368 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_4931 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12708624 |