| SpectraBase Spectrum ID |
1uP3B71FkXh |
| Name |
[3-(Hydroxymethyl)oxetan-3-yl]methanol, bis(trifluoroacetate) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.027592331 u |
| Formula |
C9H8F6O5 |
| InChI |
InChI=1S/C9H8F6O5/c10-8(11,12)5(16)19-3-7(1-18-2-7)4-20-6(17)9(13,14)15/h1-4H2 |
| InChIKey |
KLIOJFXIYGJHGU-UHFFFAOYSA-N |
| Molecular Weight |
310.148 g/mol |
| SMILES |
C1OCC1(COC(C(F)(F)F)=O)COC(C(F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961085 |
![[3-(Hydroxymethyl)oxetan-3-yl]methanol, bis(trifluoroacetate)](/api/spectrum/1uP3B71FkXh/structure.png?h=300&w=458 "[3-(Hydroxymethyl)oxetan-3-yl]methanol, bis(trifluoroacetate)")
