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4-[1-acetamido-3-(3,4,5-trimethoxyphenyl)propyl]-2-methoxytropone
SpectraBase Compound ID CVnKGaRfuqj
InChI InChI=1S/C22H27NO6/c1-14(24)23-17(16-7-6-8-18(25)19(13-16)26-2)10-9-15-11-20(27-3)22(29-5)21(12-15)28-4/h6-8,11-13,17H,9-10H2,1-5H3,(H,23,24)
InChIKey IYVHJEUAKGAJQY-UHFFFAOYSA-N
Mol Weight 401.46 g/mol
Molecular Formula C22H27NO6
Exact Mass 401.183838 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BqlX8anhluu
Name 4-[1-acetamido-3-(3,4,5-trimethoxyphenyl)propyl]-2-methoxytropone
Alternate Name(s) N-[1-(6-methoxy-5-oxo-1,3,6-cycloheptatrien-1-yl)-3-(3,4,5-trimethoxyphenyl)propyl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO6
InChI InChI=1S/C22H27NO6/c1-14(24)23-17(16-7-6-8-18(25)19(13-16)26-2)10-9-15-11-20(27-3)22(29-5)21(12-15)28-4/h6-8,11-13,17H,9-10H2,1-5H3,(H,23,24)
InChIKey IYVHJEUAKGAJQY-UHFFFAOYSA-N
Molecular Weight 401.459 g/mol
SMILES N(C(C=1C=C(C(C=CC1)=O)OC)CCc1cc(OC)c(c(c1)OC)OC)C(=O)C
SPLASH splash10-0ff1-0940300000-3f6a47a990d70522ebb6
Source of Spectrum AJ-56-3108-6
Wiley ID 1369998