SpectraBase Compound ID | GoyDl7tsYzt |
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InChI | InChI=1S/C10H13NO4/c1-7(2)15-10-6-8(11(12)13)4-5-9(10)14-3/h4-7H,1-3H3 |
InChIKey | KRMWWKXKXPFGSF-UHFFFAOYSA-N |
Mol Weight | 211.22 g/mol |
Molecular Formula | C10H13NO4 |
Exact Mass | 211.084458 g/mol |
SpectraBase Spectrum ID | 7obrWjAJPaH |
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Name | 2-Methoxy-5-nitrophenol, isopropyl ether |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 211.084457899 u |
Formula | C10H13NO4 |
InChI | InChI=1S/C10H13NO4/c1-7(2)15-10-6-8(11(12)13)4-5-9(10)14-3/h4-7H,1-3H3 |
InChIKey | KRMWWKXKXPFGSF-UHFFFAOYSA-N |
Molecular Weight | 211.217 g/mol |
SMILES | C1(=CC(OC(C)C)=C(C=C1)OC)N(=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.947084 |