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(8R)-5,6,7,8-Tetrahydro-4-(4'-chlorophenyl)-6,6,8-trimethyl-8-hydroxy-5,7-methylenebridge-2-quinazolineamine
SpectraBase Compound ID 1dGJA7otmTQ
InChI InChI=1S/C18H20ClN3O/c1-17(2)11-8-12(17)18(3,23)15-13(11)14(21-16(20)22-15)9-4-6-10(19)7-5-9/h4-7,11-12,23H,8H2,1-3H3,(H2,20,21,22)/t11-,12-,18-/m1/s1
InChIKey CHWLTRSSJUQTCT-SEDUGSJDSA-N
Mol Weight 329.83 g/mol
Molecular Formula C18H20ClN3O
Exact Mass 329.12949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B6CB7qvhmZS
Name (8R)-5,6,7,8-Tetrahydro-4-(4'-chlorophenyl)-6,6,8-trimethyl-8-hydroxy-5,7-methylenebridge-2-quinazolineamine
Appearance Colorless transparent crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20ClN3O
InChI InChI=1S/C18H20ClN3O/c1-17(2)11-8-12(17)18(3,23)15-13(11)14(21-16(20)22-15)9-4-6-10(19)7-5-9/h4-7,11-12,23H,8H2,1-3H3,(H2,20,21,22)/t11-,12-,18-/m1/s1
InChIKey CHWLTRSSJUQTCT-SEDUGSJDSA-N
Instrument Name American Agilent 5975C
Ionization Type EI
Molecular Weight 329.831 g/mol
Optical Rotation [a]D20 = -96.4 (c = 0.1, CH3OH)
SMILES Nc1nc2c([C@@]3(C([C@]([C@@]2(C)O)(C3)[H])(C)C)[H])c(n1)-c1ccc(cc1)Cl
SPLASH splash10-03di-0090000000-98c7218e08c7f2a48e02
Source of Spectrum CN103333122A
Wiley ID 1847506