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trans-(4aS,8aS)-2-(4-fluorophenyl)-4a,5,6,7,8,8a-hexahydro-3H-quinazolin-4-one
SpectraBase Compound ID 6gTsWPoCc4y
InChI InChI=1S/C14H15FN2O/c15-10-7-5-9(6-8-10)13-16-12-4-2-1-3-11(12)14(18)17-13/h5-8,11-12H,1-4H2,(H,16,17,18)/t11-,12-/m0/s1
InChIKey GKLPISQYQZUTDD-RYUDHWBXSA-N
Mol Weight 246.29 g/mol
Molecular Formula C14H15FN2O
Exact Mass 246.116841 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GKx54JvnJlW
Name trans-(4aS,8aS)-2-(4-fluorophenyl)-4a,5,6,7,8,8a-hexahydro-3H-quinazolin-4-one
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Formula C14H15FN2O
InChI InChI=1S/C14H15FN2O/c15-10-7-5-9(6-8-10)13-16-12-4-2-1-3-11(12)14(18)17-13/h5-8,11-12H,1-4H2,(H,16,17,18)/t11-,12-/m0/s1
InChIKey GKLPISQYQZUTDD-RYUDHWBXSA-N
Instrument Name VG Analytical 7070E
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19960131)10_2_214
Molecular Weight 246.285 g/mol
SMILES N1C([C@@]2([C@@](N=C1c1ccc(cc1)F)(CCCC2)[H])[H])=O
SPLASH splash10-0002-1490000000-5ccdeb4388a5d4cdfd03
Source of Spectrum RCM-10-215-7b
Wiley ID 1836009