SpectraBase Spectrum ID |
21bHTTNNk2I |
Name |
isoquinoline, 1-(chloromethyl)-3-ethyl-3,4-dihydro-3-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 |
221.097127219 u |
Formula |
C13H16ClN |
InChI |
InChI=1S/C13H16ClN/c1-3-13(2)8-10-6-4-5-7-11(10)12(9-14)15-13/h4-7H,3,8-9H2,1-2H3 |
InChIKey |
JINDIHCPVBWINR-UHFFFAOYSA-N |
Molecular Weight |
221.731 g/mol |
NMR Offset |
14.8478 |
NMR Spectrometer Frequency |
250.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_6885 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9321145; Lab Info: AJM; Lab Number: AJM-PeMi016 |
Temperature |
23.85 °C |