SpectraBase Spectrum ID |
rfdCuPsVvj |
Name |
7-Acetyl-9-methylene-trans-bicyclo[4.3.0]non-7-ene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
176.120115134 u |
Formula |
C12H16O |
InChI |
InChI=1S/C12H16O/c1-8-7-12(9(2)13)11-6-4-3-5-10(8)11/h7,10-11H,1,3-6H2,2H3/t10-,11+/m1/s1 |
InChIKey |
ZKTXINXAKXJELN-MNOVXSKESA-N |
Molecular Weight |
176.259 g/mol |
SMILES |
C1(=CC(=C)[C@@]2([C@@]1(CCCC2)[H])[H])C(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.908828 |