SpectraBase Spectrum ID |
Hd1pUKmfn4y |
Name |
piperazinium, 1-(1,3-benzodioxol-5-ylmethyl)-4-[(2-oxo-2H-1-benzopyran-3-yl)carbonyl]-, 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 |
428.113899479 u |
Formula |
C22H21ClN2O5 |
InChI |
InChI=1S/C22H20N2O5.ClH/c25-21(17-12-16-3-1-2-4-18(16)29-22(17)26)24-9-7-23(8-10-24)13-15-5-6-19-20(11-15)28-14-27-19;/h1-6,11-12H,7-10,13-14H2;1H |
InChIKey |
IQEIPPWJLPIDMN-UHFFFAOYSA-N |
Molecular Weight |
428.872 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_4367 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9311236; Lab Info: PNA; Lab Number: PNA-0000745 |