| SpectraBase Spectrum ID |
BLqMcATke1P |
| Name |
1H-Cycloprop[C]inden-4(5H)-one, hexahydro-1A-methoxy-3A-methyl-, (1A.alpha.,3A.alpha.,7as*)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
194.130679818 u |
| Formula |
C12H18O2 |
| InChI |
InChI=1S/C12H18O2/c1-10-6-7-12(14-2)8-11(10,12)5-3-4-9(10)13/h3-8H2,1-2H3/t10-,11-,12-/m0/s1 |
| InChIKey |
RWTZBMRYEHVPGT-SRVKXCTJSA-N |
| Molecular Weight |
194.274 g/mol |
| SMILES |
[C@]123[C@@](CC[C@]3(C(=O)CCC1)C)(OC)C2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.867833 |
![1H-Cycloprop[c]inden-4(5H)-one, hexahydro-1a-methoxy-3a-methyl-, (1a.alpha.,3a.alpha.,7aS*)-](/api/spectrum/BLqMcATke1P/structure.png?h=300&w=458 "1H-Cycloprop[c]inden-4(5H)-one, hexahydro-1a-methoxy-3a-methyl-, (1a.alpha.,3a.alpha.,7aS*)-")
