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{8-(3-Hydroxyprop-1-ynyl)naphtho[2,1-d][1,3]dioxol-7-yl}methyl Acetate
SpectraBase Compound ID 49aODM4z9D1
InChI InChI=1S/C17H14O5/c1-11(19)20-9-14-7-13-4-5-16-17(22-10-21-16)15(13)8-12(14)3-2-6-18/h4-5,7-8,18H,6,9-10H2,1H3
InChIKey YHMFPTRMJCDYAY-UHFFFAOYSA-N
Mol Weight 298.29 g/mol
Molecular Formula C17H14O5
Exact Mass 298.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D3KOPb18BPa
Name {8-(3-Hydroxyprop-1-ynyl)naphtho[2,1-d][1,3]dioxol-7-yl}methyl Acetate
Comments Less than 3 mono-isotopic peaks
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Formula C17H14O5
InChI InChI=1S/C17H14O5/c1-11(19)20-9-14-7-13-4-5-16-17(22-10-21-16)15(13)8-12(14)3-2-6-18/h4-5,7-8,18H,6,9-10H2,1H3
InChIKey YHMFPTRMJCDYAY-UHFFFAOYSA-N
Molecular Weight 298.294 g/mol
SMILES OCC#Cc1cc2c3c(OCO3)ccc2cc1COC(=O)C
SPLASH splash10-000b-0090000000-1409314d5e47bc17e824
Source of Spectrum U1-2010-6553-5g
Synonyms acetic acid [8-(3-hydroxyprop-1-ynyl)-7-benzo[g][1,3]benzodioxolyl]methyl ester [8-(3-hydroxyprop-1-ynyl)benzo[g][1,3]benzodioxol-7-yl]methyl acetate [8-(3-oxidanylprop-1-ynyl)benzo[g][1,3]benzodioxol-7-yl]methyl ethanoate
Wiley ID 1664652