| SpectraBase Spectrum ID |
98Vixpjq7ab |
| Name |
(2E)-4-Tetrahydropyranyloxy-3-methylbut-2-enyl acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
228.136159120 u |
| Formula |
C12H20O4 |
| InChI |
InChI=1S/C12H20O4/c1-10(3-8-15-11(2)13)9-16-12-4-6-14-7-5-12/h3,12H,4-9H2,1-2H3/b10-3+ |
| InChIKey |
JBCYFGMUDZJCHJ-XCVCLJGOSA-N |
| Molecular Weight |
228.288 g/mol |
| SMILES |
C(=O)(OC\C=C\(COC1CCOCC1)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962331 |
