SpectraBase Spectrum ID |
H3A8At8Pwnq |
Name |
1,2,4-tris(acetyloxy)-5-oxo-6-(2,4,6-trichlorophenyl)hexan-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 |
511.020364319 u |
Formula |
C19H20Cl3NO9 |
InChI |
InChI=1S/C19H20Cl3NO9/c1-8(24)29-7-15(30-9(2)25)17(31-10(3)26)18(32-11(4)27)19(28)23-16-13(21)5-12(20)6-14(16)22/h5-6,15,17-18H,7H2,1-4H3,(H,23,28)/t15-,17-,18+/m0/s1 |
InChIKey |
DZVCIZYWXBFEKF-RYQLBKOJSA-N |
Molecular Weight |
512.726 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_2368 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/9016341; Lab Info: RVP; Lab Number: RVP-rrv2574 |