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2,11-bis(Trifluoromethyl)tricyclo[10.4.1.0(3,10)]heptadeca-2,10,12,14,16-pentaene
SpectraBase Compound ID AXt2byeLaM9
InChI InChI=1S/C19H18F6/c20-18(21,22)16-12-7-5-6-8-13(11-12)17(19(23,24)25)15-10-4-2-1-3-9-14(15)16/h5-8H,1-4,9-11H2
InChIKey PDUFHWQPWXNHRW-UHFFFAOYSA-N
Mol Weight 360.34 g/mol
Molecular Formula C19H18F6
Exact Mass 360.13127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FIGuke7Vcy7
Name 2,11-bis(Trifluoromethyl)tricyclo[10.4.1.0(3,10)]heptadeca-2,10,12,14,16-pentaene
Comments Less than 3 mono-isotopic peaks
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Formula C19H18F6
InChI InChI=1S/C19H18F6/c20-18(21,22)16-12-7-5-6-8-13(11-12)17(19(23,24)25)15-10-4-2-1-3-9-14(15)16/h5-8H,1-4,9-11H2
InChIKey PDUFHWQPWXNHRW-UHFFFAOYSA-N
Molecular Weight 360.343 g/mol
SMILES C1=2C(=C(C3=CC=CC=C(C2C(F)(F)F)C3)C(F)(F)F)CCCCCC1
SPLASH splash10-03dl-0079000000-be9782e1e9e87748da30
Source of Spectrum U-1996-775-11
Synonyms 2,11-bis(trifluoromethyl)tricyclo[10.4.1.0(3,10)]heptadeca-1(16),2,10,12,14-pentaene
Wiley ID 768462