SpectraBase Spectrum ID |
2hrTTtoKq5l |
Name |
6-(2,6-dimethylphenyl)-3-methyl-5-oxohexan-3-ylium chloride |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
256.109088882 u |
Formula |
C11H17ClN4O |
InChI |
InChI=1S/C11H16N4O.ClH/c1-7-5-4-6-8(2)9(7)14-11(16)15-10(12)13-3;/h4-6,13H,12H2,1-3H3,(H-,14,15,16);1H |
InChIKey |
SDJZCSYHAMQGTF-UHFFFAOYSA-N |
Molecular Weight |
256.737 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_112 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/8305222; Lab Info: JMR; Lab Number: JMR-D000047 |
Temperature |
29.85 °C |