| SpectraBase Spectrum ID |
FP6rzPydND |
| Name |
8.alpha.-Ethoxycarbonyl-1-.beta.-methyl-(6H.beta.)-bicyclo[4.2.1]nona-2,4-diene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
206.130679818 u |
| Formula |
C13H18O2 |
| InChI |
InChI=1S/C13H18O2/c1-3-15-13(14)12-8-10-6-4-5-9(2)11(12)7-10/h4-6,10-12H,3,7-8H2,1-2H3/t10?,11-,12-/m1/s1 |
| InChIKey |
PUHFYHCYYKGBGQ-PQDIPPBSSA-N |
| Molecular Weight |
206.285 g/mol |
| SMILES |
[C@@]12([C@](C(=O)OCC)(CC(C2)C=CC=C1C)[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900196 |
![8.alpha.-Ethoxycarbonyl-1-.beta.-methyl-(6H.beta.)-bicyclo[4.2.1]nona-2,4-diene](/api/spectrum/FP6rzPydND/structure.png?h=300&w=458 "8.alpha.-Ethoxycarbonyl-1-.beta.-methyl-(6H.beta.)-bicyclo[4.2.1]nona-2,4-diene")
