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trans-2,7-Bis[2-(trifluoromethyl)phenyl]-10b,10c-dimethyl-10b,10c-dihydropyrene
SpectraBase Compound ID 6IApMVGmVIM
InChI InChI=1S/C32H22F6/c1-29-21-11-13-23-17-20(26-8-4-6-10-28(26)32(36,37)38)18-24(30(23,29)2)14-12-22(29)16-19(15-21)25-7-3-5-9-27(25)31(33,34)35/h3-18H,1-2H3
InChIKey KCWVKUAMDWHQEB-UHFFFAOYSA-N
Mol Weight 520.5 g/mol
Molecular Formula C32H22F6
Exact Mass 520.16257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2DuWXjLbpWR
Name trans-2,7-Bis[2-(trifluoromethyl)phenyl]-10b,10c-dimethyl-10b,10c-dihydropyrene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H22F6
InChI InChI=1S/C32H22F6/c1-29-21-11-13-23-17-20(26-8-4-6-10-28(26)32(36,37)38)18-24(30(23,29)2)14-12-22(29)16-19(15-21)25-7-3-5-9-27(25)31(33,34)35/h3-18H,1-2H3
InChIKey KCWVKUAMDWHQEB-UHFFFAOYSA-N
Molecular Weight 520.518 g/mol
SMILES C12(C3(c4cc(cc3ccc1cc(-c1c(C(F)(F)F)cccc1)cc2cc4)-c1c(C(F)(F)F)cccc1)C)C
SPLASH splash10-0a4m-0310690000-6bbc371ced85c188fe81
Source of Spectrum J-62-4417-7
Synonyms 10b,10c-dimethyl-2,7-bis[2-(trifluoromethyl)phenyl]-10b,10c-dihydropyrene
Wiley ID 1402028