| SpectraBase Spectrum ID |
8w0vYaewoSB |
| Name |
8,8-Dimethyl-2-oxooctahydro-3A,7-ethanoindene-4-carboxylic acid, me derivative |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
250.156894565 u |
| Formula |
C15H22O3 |
| InChI |
InChI=1S/C15H22O3/c1-14(2)8-15-7-9(16)6-12(15)10(14)4-5-11(15)13(17)18-3/h10-12H,4-8H2,1-3H3/t10-,11?,12?,15+/m0/s1 |
| InChIKey |
GIGBZTKBMIKFNB-ZIULKBFBSA-N |
| Molecular Weight |
250.338 g/mol |
| SMILES |
C12[C@]3(C(CC[C@@]2(C(C3)(C)C)[H])C(=O)OC)CC(C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.876089 |
