SpectraBase Spectrum ID |
6n9yTmiTMbn |
Name |
2-pyridinecarboxylic acid, 4-[[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]thio]-3,5,6-trichloro-, 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 |
489.069897972 u |
Formula |
C22H26Cl3NO3S |
InChI |
InChI=1S/C22H26Cl3NO3S/c1-8-29-20(28)16-14(23)18(15(24)19(25)26-16)30-11-9-12(21(2,3)4)17(27)13(10-11)22(5,6)7/h9-10,27H,8H2,1-7H3 |
InChIKey |
VEAKGYYIOGQIQD-UHFFFAOYSA-N |
Molecular Weight |
490.873 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_16000 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10301521; Lab Info: SIP; Lab Number: SIP-0082 |