SpectraBase Compound ID | IQkgo9fw0n7 |
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InChI | InChI=1S/C9H12O3/c1-7-3-4-8(10)9(5-7)12-6-11-2/h3-5,10H,6H2,1-2H3 |
InChIKey | ZBYCSOWELVTRCY-UHFFFAOYSA-N |
Mol Weight | 168.19 g/mol |
Molecular Formula | C9H12O3 |
Exact Mass | 168.078644 g/mol |
SpectraBase Spectrum ID | BgaFPfFL2Pn |
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Name | Phenol, 2-(methoxymethoxy)-4-methyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 168.078644243 u |
Formula | C9H12O3 |
InChI | InChI=1S/C9H12O3/c1-7-3-4-8(10)9(5-7)12-6-11-2/h3-5,10H,6H2,1-2H3 |
InChIKey | ZBYCSOWELVTRCY-UHFFFAOYSA-N |
Molecular Weight | 168.192 g/mol |
SMILES | C=1(C(=CC=C(C1)C)O)OCOC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.962281 |