| SpectraBase Spectrum ID |
IQSW8huVzeJ |
| Name |
3A,7,7-Trimethyl-3-phenyl-hexahydro-1-oxacyclopropa[C]inden-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
270.161979946 u |
| Formula |
C18H22O2 |
| InChI |
InChI=1S/C18H22O2/c1-16(2)10-9-14(19)17(3)13(11-15-18(16,17)20-15)12-7-5-4-6-8-12/h4-8,13,15H,9-11H2,1-3H3/t13-,15+,17+,18-/m0/s1 |
| InChIKey |
FUODZBAUHPVVGF-NZPGVSJUSA-N |
| Molecular Weight |
270.372 g/mol |
| SMILES |
[C@]123[C@]([C@](C4=CC=CC=C4)(C[C@]1(O2)[H])[H])(C(=O)CCC3(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.854125 |
![3a,7,7-Trimethyl-3-phenyl-hexahydro-1-oxacyclopropa[c]inden-4-one](/api/spectrum/IQSW8huVzeJ/structure.png?h=300&w=458 "3a,7,7-Trimethyl-3-phenyl-hexahydro-1-oxacyclopropa[c]inden-4-one")
