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2-methylbenzoic acid (9,10-diketo-5-o-toluoyloxy-1-anthryl) ester
SpectraBase Compound ID iTkhvsqAlR
InChI InChI=1S/C30H20O6/c1-17-9-3-5-11-19(17)29(33)35-23-15-7-13-21-25(23)27(31)22-14-8-16-24(26(22)28(21)32)36-30(34)20-12-6-4-10-18(20)2/h3-16H,1-2H3
InChIKey UAMWVGCIUOHWPD-UHFFFAOYSA-N
Mol Weight 476.48 g/mol
Molecular Formula C30H20O6
Exact Mass 476.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5eNyPI7uwrx
Name 2-methylbenzoic acid (9,10-diketo-5-o-toluoyloxy-1-anthryl) ester
Alternate Name(s) 2-methylbenzoic acid [5-[(2-methylphenyl)-oxomethoxy]-9,10-dioxo-1-anthracenyl] ester [5-(2-methylbenzoyl)oxy-9,10-dioxoanthracen-1-yl] 2-methylbenzoate [5-(2-methylbenzoyl)oxy-9,10-dioxo-1-anthryl] 2-methylbenzoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H20O6
InChI InChI=1S/C30H20O6/c1-17-9-3-5-11-19(17)29(33)35-23-15-7-13-21-25(23)27(31)22-14-8-16-24(26(22)28(21)32)36-30(34)20-12-6-4-10-18(20)2/h3-16H,1-2H3
InChIKey UAMWVGCIUOHWPD-UHFFFAOYSA-N
Molecular Weight 476.484 g/mol
SMILES c12C(c3cccc(c3C(c2cccc1OC(c1c(C)cccc1)=O)=O)OC(c1c(C)cccc1)=O)=O
SPLASH splash10-014i-0900000000-a100423aec09c99b39d0
Source of Spectrum D9-335-485-2
Wiley ID 1551015