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Pyrene, 1-(4,5-difluoro-2-nitrophenyl)-
SpectraBase Compound ID BszKO8p0wC2
InChI InChI=1S/C22H11F2NO2/c23-18-10-17(20(25(26)27)11-19(18)24)15-8-6-14-5-4-12-2-1-3-13-7-9-16(15)22(14)21(12)13/h1-11H
InChIKey YWKJQAOCPBTRFD-UHFFFAOYSA-N
Mol Weight 359.33 g/mol
Molecular Formula C22H11F2NO2
Exact Mass 359.075785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6B2fv9JIcpk
Name Pyrene, 1-(4,5-difluoro-2-nitrophenyl)-
Alternate Name(s) 1-(2-Nitro-4,5-difluorophenyl)pyrene 1-(4,5-difluoro-2-nitrophenyl)pyrene
CAS Registry Number 113600-22-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H11F2NO2
InChI InChI=1S/C22H11F2NO2/c23-18-10-17(20(25(26)27)11-19(18)24)15-8-6-14-5-4-12-2-1-3-13-7-9-16(15)22(14)21(12)13/h1-11H
InChIKey YWKJQAOCPBTRFD-UHFFFAOYSA-N
Molecular Weight 359.332 g/mol
SMILES c1(c(N(=O)=O)cc(c(c1)F)F)-c1c2c3c4c(cccc4cc2)ccc3cc1
SPLASH splash10-08fr-0109000000-0da260be8b85ab7e1ab2
Source of Spectrum J-53-1778-15
Wiley ID 1347838