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Benz[a]aceanthrylen-8-ol, 3-methyl-, acetate
SpectraBase Compound ID FmaFMZ9fkNz
InChI InChI=1S/C23H16O2/c1-13-10-11-17-20(12-13)16-8-5-9-19-22(16)21(17)15-6-3-4-7-18(15)23(19)25-14(2)24/h3-12H,1-2H3
InChIKey NQOJAYYRTJNKQM-UHFFFAOYSA-N
Mol Weight 324.38 g/mol
Molecular Formula C23H16O2
Exact Mass 324.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DIGg1UDhWSw
Name Benz[a]aceanthrylen-8-ol, 3-methyl-, acetate
Alternate Name(s) 3-Methylbenzo[a]aceanthrylen-8-yl acetate 8-Acetoxy-3-methylbenz[a]aceanthrylene
CAS Registry Number 81586-09-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H16O2
InChI InChI=1S/C23H16O2/c1-13-10-11-17-20(12-13)16-8-5-9-19-22(16)21(17)15-6-3-4-7-18(15)23(19)25-14(2)24/h3-12H,1-2H3
InChIKey NQOJAYYRTJNKQM-UHFFFAOYSA-N
Molecular Weight 324.379 g/mol
SMILES c1-2c3c(cccc3c(c3c1cccc3)OC(=O)C)-c1c2ccc(C)c1
SPLASH splash10-001i-0090000000-820fc6c8aff8e73bdb6e
Source of Spectrum KC-1982-579-0
Wiley ID 1323714