SpectraBase Compound ID | LZzlDDKrCzZ |
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InChI | InChI=1S/C10H12O3/c1-4-7-5-8(12-2)10(11)9(6-7)13-3/h4-6,11H,1H2,2-3H3 |
InChIKey | QHJGZUSJKGVMTF-UHFFFAOYSA-N |
Mol Weight | 180.2 g/mol |
Molecular Formula | C10H12O3 |
Exact Mass | 180.078644 g/mol |
SpectraBase Spectrum ID | AmEX8HwYctS |
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Name | Phenol, 4-ethenyl-2,6-dimethoxy- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 180.078644243 u |
Formula | C10H12O3 |
InChI | InChI=1S/C10H12O3/c1-4-7-5-8(12-2)10(11)9(6-7)13-3/h4-6,11H,1H2,2-3H3 |
InChIKey | QHJGZUSJKGVMTF-UHFFFAOYSA-N |
Molecular Weight | 180.203 g/mol |
SMILES | COC1=CC(C=C)=CC(OC)=C1O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.968163 |