| SpectraBase Spectrum ID |
AwVOzXakoSg |
| Name |
cis-(1R,3R)-Methyl 1-(3-acetoxyphenyl)-1,2,3,4-tetrahydro-9H-pyrido[3,4-B]indole-3-carboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
364.142307128 u |
| Formula |
C21H20N2O4 |
| InChI |
InChI=1S/C21H20N2O4/c1-12(24)27-14-7-5-6-13(10-14)19-20-16(11-18(23-19)21(25)26-2)15-8-3-4-9-17(15)22-20/h3-10,18-19,22-23H,11H2,1-2H3/t18-,19-/m1/s1 |
| InChIKey |
DRSFVCNEVMDIOD-RTBURBONSA-N |
| Molecular Weight |
364.401 g/mol |
| SMILES |
C12=C(C=3C=CC=CC3N2)C[C@@](N[C@@]1(C=1C=C(OC(=O)C)C=CC1)[H])(C(=O)OC)[H] |
![cis-(1R,3R)-Methyl 1-(3-acetoxyphenyl)-1,2,3,4-tetrahydro-9H-pyrido[3,4-b]indole-3-carboxylate](/api/spectrum/AwVOzXakoSg/structure.png?h=300&w=458 "cis-(1R,3R)-Methyl 1-(3-acetoxyphenyl)-1,2,3,4-tetrahydro-9H-pyrido[3,4-b]indole-3-carboxylate")
