SpectraBase Spectrum ID |
FCVPiHW6SWy |
Name |
2H-1-benzopyran-2-one, 6-hexyl-7-hydroxy-3-[(4-methylphenyl)sulfonyl]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
400.134445042 u |
Formula |
C22H24O5S |
InChI |
InChI=1S/C22H24O5S/c1-3-4-5-6-7-16-12-17-13-21(22(24)27-20(17)14-19(16)23)28(25,26)18-10-8-15(2)9-11-18/h8-14,23H,3-7H2,1-2H3 |
InChIKey |
MTDNAJKLNBSOFO-UHFFFAOYSA-N |
Molecular Weight |
400.489 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_4348 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13279942 |