| SpectraBase Spectrum ID |
4dm1nqwIK2z |
| Name |
cis-9-Methoxy-4B,5,6,7,8,8A-hexahydrophenanthrene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
214.135765199 u |
| Formula |
C15H18O |
| InChI |
InChI=1S/C15H18O/c1-16-15-10-11-6-2-3-7-12(11)13-8-4-5-9-14(13)15/h2-3,6-7,10,13-14H,4-5,8-9H2,1H3/t13-,14-/m1/s1 |
| InChIKey |
MTCNOIXUJHSOMS-ZIAGYGMSSA-N |
| Molecular Weight |
214.308 g/mol |
| SMILES |
C1(=CC2=CC=CC=C2[C@@]2([C@]1(CCCC2)[H])[H])OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.842235 |
