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Benz[a]anthracene, 5-fluoro-3-methoxy-7,12-dimethyl-
SpectraBase Compound ID AoVixBsQm7n
InChI InChI=1S/C21H17FO/c1-12-15-6-4-5-7-16(15)13(2)21-17-9-8-14(23-3)10-19(17)20(22)11-18(12)21/h4-11H,1-3H3
InChIKey ZKTQEUKTKBRYET-UHFFFAOYSA-N
Mol Weight 304.36 g/mol
Molecular Formula C21H17FO
Exact Mass 304.126343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EGO2qnAPuWx
Name Benz[a]anthracene, 5-fluoro-3-methoxy-7,12-dimethyl-
CAS Registry Number 82995-12-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17FO
InChI InChI=1S/C21H17FO/c1-12-15-6-4-5-7-16(15)13(2)21-17-9-8-14(23-3)10-19(17)20(22)11-18(12)21/h4-11H,1-3H3
InChIKey ZKTQEUKTKBRYET-UHFFFAOYSA-N
Molecular Weight 304.364 g/mol
SMILES c12c(c(C)c3c(c2C)cccc3)cc(c2c1ccc(OC)c2)F
SPLASH splash10-0udi-0039000000-dfb6a7b65ec50b4877a4
Source of Spectrum J-47-4343-0
Synonyms 3-Methoxy-5-fluoro-7,12-dimethylbenz[a]anthracene 5-Fluoro-3-methoxy-7,12-dimethylbenzo[a]anthracene 5-Fluoro-7,12-dimethylbenzo[a]anthracen-3-yl methyl ether
Wiley ID 1306986