| SpectraBase Spectrum ID |
6ixlaGQotkC |
| Name |
1.alpha.-Phenyl-3.beta.,3A.beta.-epoxy-octahydro-indan-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
228.115029753 u |
| Formula |
C15H16O2 |
| InChI |
InChI=1S/C15H16O2/c16-13-12(10-6-2-1-3-7-10)11-8-4-5-9-15(11)14(13)17-15/h1-3,6-7,11-12,14H,4-5,8-9H2/t11?,12-,14+,15-/m0/s1 |
| InChIKey |
QQEHLVALVYPRFH-IQVOKHDLSA-N |
| Molecular Weight |
228.291 g/mol |
| SMILES |
[C@]123[C@@](C(=O)[C@](C3CCCC1)(C1=CC=CC=C1)[H])(O2)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.868157 |
