| SpectraBase Spectrum ID |
8fMAuKe4qcJ |
| Name |
1H-Pyrido[3,4-B]indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1-(2-hydroxy-2-methylpropyl)-7-methoxy-, ethyl ester, trans-(.+-.)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
346.189257321 u |
| Formula |
C19H26N2O4 |
| InChI |
InChI=1S/C19H26N2O4/c1-5-25-18(22)15-9-13-12-7-6-11(24-4)8-14(12)21-17(13)16(20-15)10-19(2,3)23/h6-8,15-16,20-21,23H,5,9-10H2,1-4H3/t15-,16+/m0/s1 |
| InChIKey |
QIRNJEQBXOCSBV-JKSUJKDBSA-N |
| Molecular Weight |
346.427 g/mol |
| SMILES |
C12=C(C=3C=CC(=CC3N2)OC)C[C@](N[C@@]1(CC(O)(C)C)[H])(C(=O)OCC)[H] |
![1H-Pyrido[3,4-b]indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1-(2-hydroxy-2-methylpropyl)-7-methoxy-, ethyl ester, trans-(.+-.)-](/api/spectrum/8fMAuKe4qcJ/structure.png?h=300&w=458 "1H-Pyrido[3,4-b]indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1-(2-hydroxy-2-methylpropyl)-7-methoxy-, ethyl ester, trans-(.+-.)-")
