| SpectraBase Spectrum ID |
I2FZ5trgvcu |
| Name |
2(1H)-isoquinolinecarboxylic acid, 6-amino-8-(3-chlorophenyl)-5,7,7-tricyano-3,7,8,8a-tetrahydro-, ethyl ester |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C21H18ClN5O2/c1-2-29-20(28)27-7-6-15-16(9-23)19(26)21(11-24,12-25)18(17(15)10-27)13-4-3-5-14(22)8-13/h3-6,8,17-18H,2,7,10,26H2,1H3 |
| InChIKey |
CMMYOEISGOFTIF-UHFFFAOYSA-N |
| NMR Offset |
16.4447 |
| NMR Spectrometer Frequency |
250.134 |
| Observed nucleus |
1H |
| Origin |
1H_ASIOH_8516_5795 |
| Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State |
soluted |
| Solvent |
DMSO-d6 |
| Source File Reference |
VendorID: TSH/5636524; IOH_ID: IOH-012798 |
| Temperature |
297 °C |
