SpectraBase Compound ID | 2a7T3g9WvPr |
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InChI | InChI=1S/C4H8O3/c5-1-3-4(2-6)7-3/h3-6H,1-2H2 |
InChIKey | PENWRXZLRDTNBI-UHFFFAOYSA-N |
Mol Weight | 104.1 g/mol |
Molecular Formula | C4H8O3 |
Exact Mass | 104.047344 g/mol |
SpectraBase Spectrum ID | BUZ0dTM2J36 |
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Name | (3-Methyloloxiran-2-yl)methanol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 104.047344115 u |
Formula | C4H8O3 |
InChI | InChI=1S/C4H8O3/c5-1-3-4(2-6)7-3/h3-6H,1-2H2 |
InChIKey | PENWRXZLRDTNBI-UHFFFAOYSA-N |
Molecular Weight | 104.105 g/mol |
SMILES | C1(OC1CO)CO |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.967831 |