SpectraBase Spectrum ID |
U5zvR0Kszz |
Name |
4-piperidinecarboxylic acid, 1-[[5-[(E)-2-(dimethylamino)ethenyl]-3-methyl-4-isoxazolyl]sulfonyl]-, ethyl ester |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
371.151492086 u |
Formula |
C16H25N3O5S |
InChI |
InChI=1S/C16H25N3O5S/c1-5-23-16(20)13-6-10-19(11-7-13)25(21,22)15-12(2)17-24-14(15)8-9-18(3)4/h8-9,13H,5-7,10-11H2,1-4H3/b9-8+ |
InChIKey |
XOADKOYHCALRHU-CMDGGOBGSA-N |
Molecular Weight |
371.452 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_1808 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13268287 |