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2-Malonamoyl-1,8,9-trimethoxy-anthracene 3-acetic acid, methyl ester
SpectraBase Compound ID KgeKTpkZcxk
InChI InChI=1S/C23H23NO7/c1-28-16-7-5-6-12-8-13-9-14(10-18(27)29-2)19(15(25)11-17(24)26)22(30-3)21(13)23(31-4)20(12)16/h5-9H,10-11H2,1-4H3,(H2,24,26)
InChIKey RYWVAZVEKYVTRA-UHFFFAOYSA-N
Mol Weight 425.44 g/mol
Molecular Formula C23H23NO7
Exact Mass 425.147452 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K7sFJwhZBnq
Name 2-Anthraceneacetic acid, 3-(3-amino-1,3-dioxopropyl)-4,5,10-trimethoxy-, methyl ester
CAS Registry Number 115706-45-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23NO7
InChI InChI=1S/C23H23NO7/c1-28-16-7-5-6-12-8-13-9-14(10-18(27)29-2)19(15(25)11-17(24)26)22(30-3)21(13)23(31-4)20(12)16/h5-9H,10-11H2,1-4H3,(H2,24,26)
InChIKey RYWVAZVEKYVTRA-UHFFFAOYSA-N
Molecular Weight 425.437 g/mol
SMILES NC(CC(c1c(c2c(c3c(OC)cccc3cc2cc1CC(=O)OC)OC)OC)=O)=O
SPLASH splash10-004i-0005900000-63bad39b82398210a00b
Source of Spectrum C-110-6184-6
Synonyms Methyl 2-malonamoyl-1,8,9-trimethoxyanthracene-3-acetate Methyl[3-(3-amino-3-oxopropanoyl)-4,5,10-trimethoxy-2-anthryl]acetate
Wiley ID 1379638