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Tricyclo[8.2.2.24,7]hexadeca-4,6,10,12,13,15-hexaene, 5-ethyl-6-methyl-
SpectraBase Compound ID LJ0CNQE7VSX
InChI InChI=1S/C19H22/c1-3-19-14(2)17-10-8-15-4-6-16(7-5-15)9-11-18(19)13-12-17/h4-7,12-13H,3,8-11H2,1-2H3
InChIKey MXAFCDURTVIANV-UHFFFAOYSA-N
Mol Weight 250.38 g/mol
Molecular Formula C19H22
Exact Mass 250.172151 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GEfx2JRc3LZ
Name Tricyclo[8.2.2.24,7]hexadeca-4,6,10,12,13,15-hexaene, 5-ethyl-6-methyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.172150708 u
Formula C19H22
InChI InChI=1S/C19H22/c1-3-19-14(2)17-10-8-15-4-6-16(7-5-15)9-11-18(19)13-12-17/h4-7,12-13H,3,8-11H2,1-2H3
InChIKey MXAFCDURTVIANV-UHFFFAOYSA-N
Molecular Weight 250.385 g/mol
SMILES C=1(C(=C2CCC3=CC=C(CCC1C=C2)C=C3)CC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.826163