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Acetamide, N-[2-[3-(acetylamino)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-1,4-benzodi oxin-6-yl]-2-hydroxyethyl]-
SpectraBase Compound ID 1rj5F1fIuNy
InChI InChI=1S/C20H22N2O7/c1-10(23)21-9-16(27)12-4-6-17-18(8-12)29-20(22-11(2)24)19(28-17)13-3-5-14(25)15(26)7-13/h3-8,16,19-20,25-27H,9H2,1-2H3,(H,21,23)(H,22,24)
InChIKey WYNMLROKHYDRBO-UHFFFAOYSA-N
Mol Weight 402.4 g/mol
Molecular Formula C20H22N2O7
Exact Mass 402.142701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JoUtcE5n2Rc
Name Acetamide, N-[2-[3-(acetylamino)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-1,4-benzodi oxin-6-yl]-2-hydroxyethyl]-
CAS Registry Number 76735-00-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2O7
InChI InChI=1S/C20H22N2O7/c1-10(23)21-9-16(27)12-4-6-17-18(8-12)29-20(22-11(2)24)19(28-17)13-3-5-14(25)15(26)7-13/h3-8,16,19-20,25-27H,9H2,1-2H3,(H,21,23)(H,22,24)
InChIKey WYNMLROKHYDRBO-UHFFFAOYSA-N
Molecular Weight 402.403 g/mol
SMILES N(C(=O)C)CC(c1ccc2OC(c3ccc(c(c3)O)O)C(Oc2c1)NC(=O)C)O
SPLASH splash10-0udl-1900000000-c4846c1429d2f021ba26
Source of Spectrum KO-8-175-2
Synonyms 1,4-Benzodioxin, acetamide deriv. 2-(3',4'-Dihydroxyphenyl)-3-acetylamino-6-(N-acetyl-2''-amino-1''-hydroxyethyl)-2,3-dihydro-1,4-benzodioxin 2-(3',4'-Dihydroxyphenyl)-3-acetylamino-6-(N-acetyl-2''-amino-1''-hydroxyethyl)-2,3-dihydro-1,4-benzodioxin N-{2-[3-(acetylamino)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2-hydroxyethyl}acetamide
Wiley ID 1370253