| SpectraBase Spectrum ID |
At2QEmX3XfT |
| Name |
(3ar,6ar,11Bs,11CR)-10-methoxy-11B-methyl-1,2,3,3A,4,5,6A,11B,11C-decahydro-7H-benz[de]anthracen-7-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
284.177630011 u |
| Formula |
C19H24O2 |
| InChI |
InChI=1S/C19H24O2/c1-19-10-4-6-12-5-3-7-15(17(12)19)18(20)14-9-8-13(21-2)11-16(14)19/h8-9,11-12,15,17H,3-7,10H2,1-2H3/t12-,15+,17-,19-/m1/s1 |
| InChIKey |
JXEJUJRGXGUBHW-AHAHFWPDSA-N |
| SMILES |
[C@]12(C3=C(C=CC(=C3)OC)C([C@@]3([C@]1([C@@](CCC3)([H])CCC2)[H])[H])=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.902682 |
![(3aR,6aR,11bS,11cR)-10-methoxy-11b-methyl-1,2,3,3a,4,5,6a,11b,11c-decahydro-7H-benz[de]anthracen-7-one](/api/spectrum/At2QEmX3XfT/structure.png?h=300&w=458 "(3aR,6aR,11bS,11cR)-10-methoxy-11b-methyl-1,2,3,3a,4,5,6a,11b,11c-decahydro-7H-benz[de]anthracen-7-one")
