SpectraBase Compound ID | 5kp4JOvKUOD |
---|---|
InChI | InChI=1S/C6H12O2/c1-3-6(2)7-4-5-8-6/h3-5H2,1-2H3 |
InChIKey | UPZFLZYXYGBAPL-UHFFFAOYSA-N |
Mol Weight | 116.16 g/mol |
Molecular Formula | C6H12O2 |
Exact Mass | 116.08373 g/mol |
SpectraBase Spectrum ID | Bq3R34lAgJI |
---|---|
Name | 2-Ethyl-2-methyl-1,3-dioxolane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 116.083729624 u |
Formula | C6H12O2 |
InChI | InChI=1S/C6H12O2/c1-3-6(2)7-4-5-8-6/h3-5H2,1-2H3 |
InChIKey | UPZFLZYXYGBAPL-UHFFFAOYSA-N |
Molecular Weight | 116.160 g/mol |
SMILES | CCC1(OCCO1)C |
Spectrum/Structure Validation Score (Raman) | 0.986742 |