SpectraBase Compound ID | BjvCEltwOVZ |
---|---|
InChI | InChI=1S/C10H12O4/c1-12-7-4-5-8(10(11)14-3)9(6-7)13-2/h4-6H,1-3H3 |
InChIKey | IHIJFZWLGPEYPJ-UHFFFAOYSA-N |
Mol Weight | 196.2 g/mol |
Molecular Formula | C10H12O4 |
Exact Mass | 196.073559 g/mol |
SpectraBase Spectrum ID | FVKFd1kGauY |
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Name | 2,4-Dihydroxybenzoic acid, dimethyl ether, methyl ester |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 196.073558862 u |
Formula | C10H12O4 |
InChI | InChI=1S/C10H12O4/c1-12-7-4-5-8(10(11)14-3)9(6-7)13-2/h4-6H,1-3H3 |
InChIKey | IHIJFZWLGPEYPJ-UHFFFAOYSA-N |
Molecular Weight | 196.202 g/mol |
SMILES | COC=1C(=CC=C(C1)OC)C(=O)OC |
Spectrum/Structure Validation Score (Raman) | 0.97699 |