| SpectraBase Spectrum ID |
n8zw0M98Kk |
| Name |
4-Methoxy-benzoic acid 1-(3,4-dihydro-isoquinolin-1-yl)-2,2,2-trifluoro-ethyl ester |
| Alternate Name(s) |
1-(3,4-dihydro-1-isoquinolinyl)-2,2,2-trifluoroethyl 4-methoxybenzoate
1-[2-(4-Methoxyphenoxycarbonyl)-1,1,1-trifluoroethyl]-3,4-dihydroisoquinoline |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H16F3NO3 |
| InChI |
InChI=1S/C19H16F3NO3/c1-25-14-8-6-13(7-9-14)18(24)26-17(19(20,21)22)16-15-5-3-2-4-12(15)10-11-23-16/h2-9,17H,10-11H2,1H3 |
| InChIKey |
MNIPYBXLSJFDPV-UHFFFAOYSA-N |
| Molecular Weight |
363.336 g/mol |
| SMILES |
C(C=1c2c(cccc2)CCN1)(C(F)(F)F)OC(c1ccc(cc1)OC)=O |
| SPLASH |
splash10-000i-0902000000-62c9b1648dfbe4a1acbf |
| Source of Spectrum |
H1-48-291-3 |
| Wiley ID |
816230 |
