SpectraBase Compound ID | Ic81o1KXzRs |
---|---|
InChI | InChI=1S/C8H13NO4/c1-7(10)12-4-2-9-3-5-13-8(11)6-9/h2-6H2,1H3 |
InChIKey | ZKXMHNNTAFMXFA-UHFFFAOYSA-N |
Mol Weight | 187.19 g/mol |
Molecular Formula | C8H13NO4 |
Exact Mass | 187.084458 g/mol |
SpectraBase Spectrum ID | 5H79FMZiLxK |
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Name | 4-(2'-Acetoxyethyl)morpholin-2-one |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 187.084457899 u |
Formula | C8H13NO4 |
InChI | InChI=1S/C8H13NO4/c1-7(10)12-4-2-9-3-5-13-8(11)6-9/h2-6H2,1H3 |
InChIKey | ZKXMHNNTAFMXFA-UHFFFAOYSA-N |
Molecular Weight | 187.195 g/mol |
SMILES | C1(OCCN(C1)CCOC(=O)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.938978 |