SpectraBase Compound ID | C023yYC5UEo |
---|---|
InChI | InChI=1S/C14H12O3/c1-9(15)12-8-7-11-5-3-4-6-13(11)14(12)17-10(2)16/h3-8H,1-2H3 |
InChIKey | JCMFEMFOKRPFKG-UHFFFAOYSA-N |
Mol Weight | 228.25 g/mol |
Molecular Formula | C14H12O3 |
Exact Mass | 228.078644 g/mol |
SpectraBase Spectrum ID | JLTqb3rLyZ8 |
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Name | Acetic acid, 2-acetyl-1-naphthalenyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 228.078644243 u |
Formula | C14H12O3 |
InChI | InChI=1S/C14H12O3/c1-9(15)12-8-7-11-5-3-4-6-13(11)14(12)17-10(2)16/h3-8H,1-2H3 |
InChIKey | JCMFEMFOKRPFKG-UHFFFAOYSA-N |
Molecular Weight | 228.247 g/mol |
SMILES | C1=CC=CC2=C1C(=C(C=C2)C(C)=O)OC(C)=O |