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N-(2-[3-(Acetylamino)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-1,4-benzodioxin-6-yl]ethyl)acetamide
SpectraBase Compound ID 4oMODGYkb25
InChI InChI=1S/C20H22N2O6/c1-11(23)21-8-7-13-3-6-17-18(9-13)28-20(22-12(2)24)19(27-17)14-4-5-15(25)16(26)10-14/h3-6,9-10,19-20,25-26H,7-8H2,1-2H3,(H,21,23)(H,22,24)
InChIKey VUANWDRZYTXGPI-UHFFFAOYSA-N
Mol Weight 386.4 g/mol
Molecular Formula C20H22N2O6
Exact Mass 386.147786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B06thxgii0m
Name N-(2-[3-(Acetylamino)-2-(3,4-dihydroxyphenyl)-2,3-dihydro-1,4-benzodioxin-6-yl]ethyl)acetamide
CAS Registry Number 76734-99-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2O6
InChI InChI=1S/C20H22N2O6/c1-11(23)21-8-7-13-3-6-17-18(9-13)28-20(22-12(2)24)19(27-17)14-4-5-15(25)16(26)10-14/h3-6,9-10,19-20,25-26H,7-8H2,1-2H3,(H,21,23)(H,22,24)
InChIKey VUANWDRZYTXGPI-UHFFFAOYSA-N
Molecular Weight 386.404 g/mol
SMILES N(CCc1ccc2OC(C(Oc2c1)NC(C)=O)c1ccc(c(c1)O)O)C(C)=O
SPLASH splash10-000i-1900000000-d3f4fbe9f55715018b6b
Source of Spectrum KO-8-176-2
Synonyms 2-Acetylamino-7-(2-acetylaminoethyl)-3-(3,4-dihydroxyphenyl)benzodioxin N-[2-[3-acetamido-2-(3,4-dihydroxyphenyl)-2,3-dihydro-1,4-benzodioxin-6-yl]ethyl]acetamide N-[2-[3-acetamido-2-[3,4-bis(oxidanyl)phenyl]-2,3-dihydro-1,4-benzodioxin-6-yl]ethyl]ethanamide
Wiley ID 1362555