(1R,2R,5S)-1-((R)-methoxy(phenyl)methyl)-2-(4-methoxyphenyl)-2-methyl-3-oxabicyclo[3.1.0]hexane

SpectraBase Compound ID	8UG7IQ6fPOe
InChI	InChI=1S/C21H24O3/c1-20(16-9-11-18(22-2)12-10-16)21(13-17(21)14-24-20)19(23-3)15-7-5-4-6-8-15/h4-12,17,19H,13-14H2,1-3H3/t17-,19-,20-,21-/m1/s1
InChIKey	DTYLYIVFLHFCND-CWJKEVGVSA-N Google Search
Mol Weight	324.42 g/mol
Molecular Formula	C21H24O3
Exact Mass	324.172545 g/mol

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SpectraBase Spectrum ID	JcIU4R0rX0D
Name	(1R,2R,5S)-1-((R)-Methoxy(phenyl)methyl)-2-(4-methoxyphenyl)-2-methyl-3-oxabicyclo[3.1.0]hexane
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	324.172544630 u
Formula	C21H24O3
InChI	InChI=1S/C21H24O3/c1-20(16-9-11-18(22-2)12-10-16)21(13-17(21)14-24-20)19(23-3)15-7-5-4-6-8-15/h4-12,17,19H,13-14H2,1-3H3/t17-,19-,20-,21-/m1/s1
InChIKey	DTYLYIVFLHFCND-CWJKEVGVSA-N
Molecular Weight	324.420 g/mol
SMILES	[C@@]1(C2=CC=C(C=C2)OC)(C)[C@@]2([C@@](C=3C=CC=CC3)(OC)[H])[C@@](CO1)(C2)[H]
Spectrum/Structure Validation Score (Vapor Phase IR)	0.962535