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cis-(4aS,8aR)-2-(3-fluorophenyl)-4a,5,6,7,8,8a-hexahydro-3H-quinazolin-4-one
SpectraBase Compound ID HqX5t92Q9bC
InChI InChI=1S/C14H15FN2O/c15-10-5-3-4-9(8-10)13-16-12-7-2-1-6-11(12)14(18)17-13/h3-5,8,11-12H,1-2,6-7H2,(H,16,17,18)/t11-,12+/m0/s1
InChIKey DNDHPWLWOJZRFY-NWDGAFQWSA-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 9cVXrrVhILr
Name cis-(4aS,8aR)-2-(3-fluorophenyl)-4a,5,6,7,8,8a-hexahydro-3H-quinazolin-4-one
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Formula C14H15FN2O
InChI InChI=1S/C14H15FN2O/c15-10-5-3-4-9(8-10)13-16-12-7-2-1-6-11(12)14(18)17-13/h3-5,8,11-12H,1-2,6-7H2,(H,16,17,18)/t11-,12+/m0/s1
InChIKey DNDHPWLWOJZRFY-NWDGAFQWSA-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=C1c1cccc(c1)F)(CCCC2)[H])[H])=O
SPLASH splash10-0f6w-0790000000-6b4a185d40bde3a28b93
Source of Spectrum RCM-10-215-15a
Wiley ID 1835995