SpectraBase Spectrum ID |
GUDChsSamMW |
Name |
2,7-dioxaspiro[4.4]nonane-1,6-dione, 3-methyl-8-[(3-methylbutoxy)methyl]-3-[2-(phenylamino)-4-thiazolyl]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
444.171893179 u |
Formula |
C23H28N2O5S |
InChI |
InChI=1S/C23H28N2O5S/c1-15(2)9-10-28-12-17-11-23(19(26)29-17)14-22(3,30-20(23)27)18-13-31-21(25-18)24-16-7-5-4-6-8-16/h4-8,13,15,17H,9-12,14H2,1-3H3,(H,24,25) |
InChIKey |
OJATVTJDPVKGII-UHFFFAOYSA-N |
Molecular Weight |
444.546 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_1648 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/8077120; Lab Info: ART; Lab Number: ART-bac0402 |
Temperature |
29.85 °C |