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3-(But-2-en-2-yl)-2,3,4-trimethyl-2-(p-methoxyphenyl)cyclobutanone

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

3-(But-2-en-2-yl)-2,3,4-trimethyl-2-(p-methoxyphenyl)cyclobutanone
SpectraBase Compound ID GMLp2zyt9ou
InChI InChI=1S/C18H24O2/c1-7-12(2)17(4)13(3)16(19)18(17,5)14-8-10-15(20-6)11-9-14/h7-11,13H,1-6H3/b12-7-
InChIKey RMNKBBJKRFTGBZ-GHXNOFRVSA-N
Mol Weight 272.39 g/mol
Molecular Formula C18H24O2
Exact Mass 272.17763 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4JKjDJAAw7Z
Name 3-(but-2-en-2-yl)-2,3,4-Trimethyl-2-(p-methoxyphenyl)cyclobutanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 272.177630011 u
Formula C18H24O2
InChI InChI=1S/C18H24O2/c1-7-12(2)17(4)13(3)16(19)18(17,5)14-8-10-15(20-6)11-9-14/h7-11,13H,1-6H3/b12-7-
InChIKey RMNKBBJKRFTGBZ-GHXNOFRVSA-N
SMILES C1(C(\C(=C/C)C)(C)C(C1=O)C)(C=1C=CC(=CC1)OC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.829027