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2-Phenyl-4-trifluoromethyl-6,7,8,9,10,11-hexahydro-5,9;7,11-dimethano-5H-[9]annuleno[d]pyrimidine
SpectraBase Compound ID 4Ei27Wxe5C
InChI InChI=1S/C20H19F3N2/c21-20(22,23)18-16-14-7-11-6-12(8-14)10-15(9-11)17(16)24-19(25-18)13-4-2-1-3-5-13/h1-5,11-12,14-15H,6-10H2/t11-,12+,14-,15+
InChIKey AYWMAONPOLSYAX-CUFDPUGPSA-N
Mol Weight 344.38 g/mol
Molecular Formula C20H19F3N2
Exact Mass 344.150033 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2xqNBgAD5nb
Name 2-Phenyl-4-trifluoromethyl-6,7,8,9,10,11-hexahydro-5,9;7,11-dimethano-5H-[9]annuleno[d]pyrimidine
Alternate Name(s) 4-Phenyl-6-(trifluoromethyl)-3,5-diazatetracyclo[8.3.1.1(8,12).0(2,7)]pentadeca-2,4,6-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19F3N2
InChI InChI=1S/C20H19F3N2/c21-20(22,23)18-16-14-7-11-6-12(8-14)10-15(9-11)17(16)24-19(25-18)13-4-2-1-3-5-13/h1-5,11-12,14-15H,6-10H2/t11-,12+,14-,15+
InChIKey AYWMAONPOLSYAX-CUFDPUGPSA-N
Molecular Weight 344.381 g/mol
SMILES c1(c2c([C@]3(C[C@]4(C[C@@]2(C[C@](C4)(C3)[H])[H])[H])[H])nc(n1)-c1ccccc1)C(F)(F)F
SPLASH splash10-002f-0029000000-c0ca0a812c6fdfe7c6bf
Source of Spectrum H1-42-337-5
Wiley ID 757572