(1S*,2R*,8S*)-1,2-cis-1,8-trans-1-(4-Methoxyphenyl)-2,8-dimethyl-2-phenyl-1,2-dihydroazeto[2,1-b]quinazoline - Optional[Vapor Phase IR] - Spectrum

SpectraBase Compound ID	2z5nStmnwkC
InChI	InChI=1S/C25H24N2O/c1-17-21-11-7-8-12-22(21)26-24-25(2,19-9-5-4-6-10-19)23(27(17)24)18-13-15-20(28-3)16-14-18/h4-17,23H,1-3H3/t17-,23-,25+/m0/s1
InChIKey	VAXFXQAIYGJTFV-DQXHVOOISA-N Google Search
Mol Weight	368.48 g/mol
Molecular Formula	C25H24N2O
Exact Mass	368.188863 g/mol

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SpectraBase Spectrum ID	LE3QxEW9MC3
Name	(1S,2R,8S*)-1,2-cis-1,8-Trans-1-(4-methoxyphenyl)-2,8-dimethyl-2-phenyl-1,2-dihydroazeto[2,1-B]quinazoline
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	368.188863400 u
Formula	C25H24N2O
InChI	InChI=1S/C25H24N2O/c1-17-21-11-7-8-12-22(21)26-24-25(2,19-9-5-4-6-10-19)23(27(17)24)18-13-15-20(28-3)16-14-18/h4-17,23H,1-3H3/t17-,23-,25+/m0/s1
InChIKey	VAXFXQAIYGJTFV-DQXHVOOISA-N
Molecular Weight	368.480 g/mol
SMILES	C1=2N([C@@](C)(C=3C(N2)=CC=CC3)[H])[C@]([C@]1(C1=CC=CC=C1)C)(C1=CC=C(C=C1)OC)[H]
Spectrum/Structure Validation Score (Vapor Phase IR)	0.937189