8,9,11,12-Tetraacetoxydibenzo[def,p]chrysene

SpectraBase Compound ID	7yrk5dg2S3x
InChI	InChI=1S/C32H22O8/c1-15(33)37-26-13-12-22-24(30(26)38-16(2)34)14-25-29-27(22)20-9-6-5-8-19(20)21-10-7-11-23(28(21)29)31(39-17(3)35)32(25)40-18(4)36/h5-14H,1-4H3
InChIKey	HYDOAXRGOMSFAD-UHFFFAOYSA-N Google Search
Mol Weight	534.5 g/mol
Molecular Formula	C32H22O8
Exact Mass	534.131468 g/mol

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SpectraBase Spectrum ID	4SHH4HpjSIF
Name	8,9,11,12-Tetraacetoxydibenzo[def,p]chrysene
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	534.131467660 u
Formula	C32H22O8
InChI	InChI=1S/C32H22O8/c1-15(33)37-26-13-12-22-24(30(26)38-16(2)34)14-25-29-27(22)20-9-6-5-8-19(20)21-10-7-11-23(28(21)29)31(39-17(3)35)32(25)40-18(4)36/h5-14H,1-4H3
InChIKey	HYDOAXRGOMSFAD-UHFFFAOYSA-N
Molecular Weight	534.520 g/mol
SMILES	C1=2C3=C4C=CC(=C(C4=CC1=C(C(OC(=O)C)=C1C2C(C2=CC=CC=C32)=CC=C1)OC(=O)C)OC(=O)C)OC(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR)	0.808515