SpectraBase Spectrum ID |
Kk66gr9FT42 |
Name |
1-n-Butyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-hydroxyisoquinolinium -Trifluoroacetate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H28NO3 |
InChI |
InChI=1S/C23H27NO3/c1-4-5-10-20-19-9-7-6-8-18(19)16-23(25)24(20)14-13-17-11-12-21(26-2)22(15-17)27-3/h6-9,11-12,15-16H,4-5,10,13-14H2,1-3H3/p+1 |
InChIKey |
MWEQHECDJFRZJM-UHFFFAOYSA-O |
Molecular Weight |
366.481 g/mol |
SMILES |
Oc1[n+](c(c2c(cccc2)c1)CCCC)CCc1cc(OC)c(cc1)OC |
SPLASH |
splash10-0a4i-9700000000-59c3e7abb89cfa11f9b4 |
Source of Spectrum |
J-62-2090-11 |
Synonyms |
1-Butyl-2-[2-(3,4-dimethoxy-phenyl)-ethyl]-3-hydroxy-isoquinolinium |
Wiley ID |
1351516 |