| SpectraBase Spectrum ID |
LTkkxex6WL5 |
| Name |
exo-6-Methyl-3ndo-6-(carbethoxymethyl)bicyclo[3.2.0]-heptan-7-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
210.125594437 u |
| Formula |
C12H18O3 |
| InChI |
InChI=1S/C12H18O3/c1-3-15-10(13)7-12(2)9-6-4-5-8(9)11(12)14/h8-9H,3-7H2,1-2H3 |
| InChIKey |
AULSRIPFYKBFSO-UHFFFAOYSA-N |
| Molecular Weight |
210.273 g/mol |
| SMILES |
C1(C(=O)C2C1CCC2)(CC(=O)OCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.981567 |
![exo-6-Methyl-3ndo-6-(carbethoxymethyl)bicyclo[3.2.0]-heptan-7-one](/api/spectrum/LTkkxex6WL5/structure.png?h=300&w=458 "exo-6-Methyl-3ndo-6-(carbethoxymethyl)bicyclo[3.2.0]-heptan-7-one")
