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3-Methoxy-4,5-diethyltricyclo[8.4.1.0(2,7)]pentadeca-1(14),2(7),3,5,8,10,12-heptaen-6-ol
SpectraBase Compound ID 3JBwl2pRUPl
InChI InChI=1S/C20H22O2/c1-4-15-16(5-2)20(22-3)18-14-9-7-6-8-13(12-14)10-11-17(18)19(15)21/h6-11,21H,4-5,12H2,1-3H3
InChIKey IIHRCSRULACALZ-UHFFFAOYSA-N
Mol Weight 294.39 g/mol
Molecular Formula C20H22O2
Exact Mass 294.16198 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FCs5jyyM0yP
Name 3-Methoxy-4,5-diethyltricyclo[8.4.1.0(2,7)]pentadeca-1(14),2(7),3,5,8,10,12-heptaen-6-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 294.161979946 u
Formula C20H22O2
InChI InChI=1S/C20H22O2/c1-4-15-16(5-2)20(22-3)18-14-9-7-6-8-13(12-14)10-11-17(18)19(15)21/h6-11,21H,4-5,12H2,1-3H3
InChIKey IIHRCSRULACALZ-UHFFFAOYSA-N
SMILES C12=C(C=3CC(C=C2)=CC=CC3)C(OC)=C(C(=C1O)CC)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.92436