| SpectraBase Spectrum ID |
CmooRcRKB5V |
| Name |
1-Isoquinolinemethanol, .alpha.-1,3-benzodioxol-5-yl-2-(2,2-dimethyl-1-oxopropyl)-1,2,3,4-tetrahydro-, (R*,S*)-(.+-.)- |
| Alternate Name(s) |
(R)-1,3-benzodioxol-5-yl[(1S)-2-(2,2-dimethylpropanoyl)-1,2,3,4-tetrahydro-1-isoquinolinyl]methanol
U-(tert-butyl)-{1,2,3,4-tetrahydro-1-[.alpha.-hydroxy-2,3-(methylenedioxy)benzyl]isochinolin-2-yl}ketone |
| CAS Registry Number |
114621-91-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H25NO4 |
| InChI |
InChI=1S/C22H25NO4/c1-22(2,3)21(25)23-11-10-14-6-4-5-7-16(14)19(23)20(24)15-8-9-17-18(12-15)27-13-26-17/h4-9,12,19-20,24H,10-11,13H2,1-3H3/t19-,20+/m0/s1 |
| InChIKey |
OYPPDFGILQUDCS-VQTJNVASSA-N |
| Molecular Weight |
367.445 g/mol |
| SMILES |
O[C@@]([C@]1(N(C(C(C)(C)C)=O)CCc2ccccc12)[H])(c1cc2OCOc2cc1)[H] |
| SPLASH |
splash10-067i-9570000000-2a32d1ff4be8c20e5445 |
| Source of Spectrum |
H-70-1369-11 |
| Wiley ID |
1352626 |
