| SpectraBase Spectrum ID |
uVLC3iq7xF |
| Name |
9-Acetyl-3.beta.-(acetoxy)-10,11.beta.-dimethyl-decahydro-11H-benzo[A]fluorene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.219494823 u |
| Formula |
C23H30O3 |
| InChI |
InChI=1S/C23H30O3/c1-13-18(14(2)24)7-8-19-20-6-5-16-11-17(26-15(3)25)9-10-23(16,4)22(20)12-21(13)19/h7-8,16-17,20,22H,5-6,9-12H2,1-4H3/t16-,17-,20+,22-,23?/m0/s1 |
| InChIKey |
PFLVHYXXBVUMMU-DOMRPIMXSA-N |
| Molecular Weight |
354.490 g/mol |
| SMILES |
C12=C([C@]3(CC[C@@]4(C([C@]3(C2)[H])(CC[C@](OC(=O)C)(C4)[H])C)[H])[H])C=CC(=C1C)C(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.85783 |
![9-Acetyl-3.beta.-(acetoxy)-10,11.beta.-dimethyl-decahydro-11H-benzo[a]fluorene](/api/spectrum/uVLC3iq7xF/structure.png?h=300&w=458 "9-Acetyl-3.beta.-(acetoxy)-10,11.beta.-dimethyl-decahydro-11H-benzo[a]fluorene")
