| SpectraBase Compound ID | 5Bx4gMcMGbf |
|---|---|
| InChI | InChI=1S/C10H18O3/c1-3-5-6-7-9-13-10(11)12-8-4-2/h5-6H,3-4,7-9H2,1-2H3/b6-5+ |
| InChIKey | LFNUBMNIGPZAQY-AATRIKPKSA-N |
| Mol Weight | 186.25 g/mol |
| Molecular Formula | C10H18O3 |
| Exact Mass | 186.125594 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6SiFNiYmaBo |
|---|---|
| Name | (E)-hex-3-en-1-yl Propyl carbonate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.125594437 u |
| Formula | C10H18O3 |
| InChI | InChI=1S/C10H18O3/c1-3-5-6-7-9-13-10(11)12-8-4-2/h5-6H,3-4,7-9H2,1-2H3/b6-5+ |
| InChIKey | LFNUBMNIGPZAQY-AATRIKPKSA-N |
| Molecular Weight | 186.251 g/mol |
| SMILES | CC\C=C\CCOC(OCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.941817 |