(1R,2R,5R,7R,8R) 7-Benzyloxy-2,6,6-trimthyl-8-methoxytricyclo[6.2.1.0(1,5)]undecane

SpectraBase Compound ID	fn0MkCpERg
InChI	InChI=1S/C22H32O2/c1-16-10-11-18-20(2,3)19(24-14-17-8-6-5-7-9-17)22(23-4)13-12-21(16,18)15-22/h5-9,16,18-19H,10-15H2,1-4H3/t16-,18+,19-,21-,22-/m1/s1
InChIKey	SCEQUKHRHYIHCF-YICCBXQDSA-N Google Search
Mol Weight	328.5 g/mol
Molecular Formula	C22H32O2
Exact Mass	328.24023 g/mol

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SpectraBase Spectrum ID	HXT4lju5uSh
Name	(1R,2R,5R,7R,8R) 7-Benzyloxy-2,6,6-trimthyl-8-methoxytricyclo[6.2.1.0(1,5)]undecane
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	328.240230268 u
Formula	C22H32O2
InChI	InChI=1S/C22H32O2/c1-16-10-11-18-20(2,3)19(24-14-17-8-6-5-7-9-17)22(23-4)13-12-21(16,18)15-22/h5-9,16,18-19H,10-15H2,1-4H3/t16-,18+,19-,21-,22-/m1/s1
InChIKey	SCEQUKHRHYIHCF-YICCBXQDSA-N
Molecular Weight	328.496 g/mol
SMILES	[C@]123[C@](C(C)(C)[C@]([C@@](C3)(OC)CC1)(OCC1=CC=CC=C1)[H])(CC[C@]2(C)[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR)	0.91337