| SpectraBase Spectrum ID |
LFMrIWcJIBP |
| Name |
2ah-Cyclobuta[F]cyclopent[cd]inden-2A-ol, 1,2,3,4,4A,5,5A,7A-octahydro-5A-methoxy-, (2A.alpha.,4A.alpha.,5A.beta.,7A.beta.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
218.130679818 u |
| Formula |
C14H18O2 |
| InChI |
InChI=1S/C14H18O2/c1-16-14-7-4-11(14)10-3-6-13(15)5-2-9(8-14)12(10)13/h4,7,9,11,15H,2-3,5-6,8H2,1H3/t9-,11+,13-,14+/m0/s1 |
| InChIKey |
CUFZLKDDWBRTBI-PCGAWMICSA-N |
| Molecular Weight |
218.296 g/mol |
| SMILES |
C12=C3[C@](CC[C@]3(O)CC1)([H])C[C@]1([C@@]2(C=C1)[H])OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.899517 |
![2aH-Cyclobuta[f]cyclopent[cd]inden-2a-ol, 1,2,3,4,4a,5,5a,7a-octahydro-5a-methoxy-, (2a.alpha.,4a.alpha.,5a.beta.,7a.beta.)-](/api/spectrum/LFMrIWcJIBP/structure.png?h=300&w=458 "2aH-Cyclobuta[f]cyclopent[cd]inden-2a-ol, 1,2,3,4,4a,5,5a,7a-octahydro-5a-methoxy-, (2a.alpha.,4a.alpha.,5a.beta.,7a.beta.)-")
