| SpectraBase Spectrum ID |
IUvg1yI2FUT |
| Name |
5-Bromo-8-methoxy-(1S,3R)-dimethyl-1,2,3,4-tetrahydroisoquinoline |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16BrNO |
| InChI |
InChI=1S/C12H16BrNO/c1-7-6-9-10(13)4-5-11(15-3)12(9)8(2)14-7/h4-5,7-8,14H,6H2,1-3H3/t7-,8+/m1/s1 |
| InChIKey |
XRJKKLGDRRIAQW-SFYZADRCSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jnatprod.6b00967 |
| Molecular Weight |
270.170 g/mol |
| Optical Rotation |
[a]D22 = -148.2 (c = 0.09, MeOH) |
| Reported Formula |
C12H16BrNO |
| SMILES |
N1[C@](c2c(ccc(c2C[C@]1(C)[H])Br)OC)(C)[H] |
| SPLASH |
splash10-0zfr-0090000000-efcb15243ccd05052f26 |
| Source of Spectrum |
G4-80-455-15 |
| Wiley ID |
1874661 |
