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2-(6-(4-fluoro-3-methylphenyl)-2,2-dimethylbenzo[d][1,3]dioxol-5-yl)ethyl methyl carbonate
SpectraBase Compound ID Ku4w4M9KH7h
InChI InChI=1S/C20H21FO5/c1-12-9-13(5-6-16(12)21)15-11-18-17(25-20(2,3)26-18)10-14(15)7-8-24-19(22)23-4/h5-6,9-11H,7-8H2,1-4H3
InChIKey BLLOFOHWSHZCTN-UHFFFAOYSA-N
Mol Weight 360.38 g/mol
Molecular Formula C20H21FO5
Exact Mass 360.137302 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57cpmmNdr4V
Name 2-(6-(4-fluoro-3-methylphenyl)-2,2-dimethylbenzo[d][1,3]dioxol-5-yl)ethyl methyl carbonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21FO5
InChI InChI=1S/C20H21FO5/c1-12-9-13(5-6-16(12)21)15-11-18-17(25-20(2,3)26-18)10-14(15)7-8-24-19(22)23-4/h5-6,9-11H,7-8H2,1-4H3
InChIKey BLLOFOHWSHZCTN-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol8012292
Molecular Weight 360.381 g/mol
SMILES CC1(Oc2c(cc(c(CCOC(=O)OC)c2)-c2cc(c(cc2)F)C)O1)C
SPLASH splash10-0a4i-9000000000-99f086f43aa09d2af17b
Source of Spectrum A1-10-3457/SMS4-3e
Wiley ID 1759687