SpectraBase Spectrum ID |
20cRMCbJc5p |
Name |
1,2,4-tris(acetyloxy)-6-(4-nitrophenyl)-5-oxohexan-3-yl acetate |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
454.122359525 u |
Formula |
C19H22N2O11 |
InChI |
InChI=1S/C19H22N2O11/c1-10(22)29-9-16(30-11(2)23)17(31-12(3)24)18(32-13(4)25)19(26)20-14-5-7-15(8-6-14)21(27)28/h5-8,16-18H,9H2,1-4H3,(H,20,26)/t16-,17-,18+/m0/s1 |
InChIKey |
JQMMGKHXZTXALX-OKZBNKHCSA-N |
Molecular Weight |
454.388 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_2369 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/9016491; Lab Info: RVP; Lab Number: RVP-rrv2572 |