SpectraBase Spectrum ID |
3xltsntOKAd |
Name |
1H-indole-3-carboxylic acid, 6-bromo-1-cyclohexyl-5-hydroxy-2-methyl- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
351.047006441 u |
Formula |
C16H18BrNO3 |
InChI |
InChI=1S/C16H18BrNO3/c1-9-15(16(20)21)11-7-14(19)12(17)8-13(11)18(9)10-5-3-2-4-6-10/h7-8,10,19H,2-6H2,1H3,(H,20,21) |
InChIKey |
AKYBYDDSYWLFCB-UHFFFAOYSA-N |
Molecular Weight |
352.228 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_3432 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13266190; Lab Info: JMR; Lab Number: JMR-0002292 |