SpectraBase Spectrum ID |
E3LD1mSUBOX |
Name |
Ethyl 2-[(1R*,2R*)-2-methylcyclopentyl]propionate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
184.146329882 u |
Formula |
C11H20O2 |
InChI |
InChI=1S/C11H20O2/c1-4-13-11(12)9(3)10-7-5-6-8(10)2/h8-10H,4-7H2,1-3H3/t8-,9?,10-/m1/s1 |
InChIKey |
CLCYSESBMFHWKD-RCAUJQPQSA-N |
Molecular Weight |
184.279 g/mol |
SMILES |
C(C([C@]1([C@@](CCC1)(C)[H])[H])C)(=O)OCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.987355 |