| SpectraBase Spectrum ID |
GafgbGt8CMa |
| Name |
Dibenz[B,D]cycloheptane, 9-acetamino-7-hydroxy-2,3,4-trimethoxy- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
357.157622840 u |
| Formula |
C20H23NO5 |
| InChI |
InChI=1S/C20H23NO5/c1-11(22)21-16-8-5-12-9-17(24-2)19(25-3)20(26-4)18(12)14-7-6-13(23)10-15(14)16/h6-7,9-10,16,23H,5,8H2,1-4H3,(H,21,22) |
| InChIKey |
WJJZQSCOTJYYSP-UHFFFAOYSA-N |
| Molecular Weight |
357.406 g/mol |
| SMILES |
C12=C(CCC(C3=C2C=CC(=C3)O)NC(=O)C)C=C(C(=C1OC)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916718 |
![Dibenz[B,D]cycloheptane, 9-acetamino-7-hydroxy-2,3,4-trimethoxy-](/api/spectrum/GafgbGt8CMa/structure.png?h=300&w=458 "Dibenz[B,D]cycloheptane, 9-acetamino-7-hydroxy-2,3,4-trimethoxy-")
