| SpectraBase Spectrum ID |
2c0AosM1bhd |
| Name |
Cyclopenta-1,3-dioxin-4(4ah)-one, tetrahydro-4A-methyl-, (4ar-cis)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
156.078644243 u |
| Formula |
C8H12O3 |
| InChI |
InChI=1S/C8H12O3/c1-8-4-2-3-6(8)10-5-11-7(8)9/h6H,2-5H2,1H3/t6-,8+/m0/s1 |
| InChIKey |
JJSPHTBBJMQCSU-POYBYMJQSA-N |
| Molecular Weight |
156.181 g/mol |
| SMILES |
[C@]12(C(OCO[C@]2(CCC1)[H])=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.911704 |
