(1S,3R,4S)-2,2,4-trimethyl-6-methylene-8-phenyl-3-bicyclo[2.2.2]oct-7-enol

SpectraBase Compound ID	Cv9Nhhz6Twi
InChI	InChI=1S/C18H22O/c1-12-11-18(4)15(13-8-6-5-7-9-13)10-14(12)17(2,3)16(18)19/h5-10,14,16,19H,1,11H2,2-4H3/t14-,16+,18-/m0/s1
InChIKey	ITWMPGJKCLTYGV-LESCRADOSA-N Google Search
Mol Weight	254.37 g/mol
Molecular Formula	C18H22O
Exact Mass	254.167065 g/mol

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SpectraBase Spectrum ID	FnCo0JH2w2z
Name	(1S,3R,4S)-2,2,4-Trimethyl-6-methylene-8-phenyl-3-bicyclo[2.2.2]oct-7-enol
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	254.167065327 u
Formula	C18H22O
InChI	InChI=1S/C18H22O/c1-12-11-18(4)15(13-8-6-5-7-9-13)10-14(12)17(2,3)16(18)19/h5-10,14,16,19H,1,11H2,2-4H3/t14-,16+,18-/m0/s1
InChIKey	ITWMPGJKCLTYGV-LESCRADOSA-N
Molecular Weight	254.373 g/mol
SMILES	[C@@]12(C(=C[C@](C(C2)=C)([H])C([C@]1(O)[H])(C)C)C=1C=CC=CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR)	0.948004