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(2-Methyl-2-phenylcyclohexyl)acetic acid, (trans)-
SpectraBase Compound ID 45PfAAUqY7g
InChI InChI=1S/C15H20O2/c1-15(12-7-3-2-4-8-12)10-6-5-9-13(15)11-14(16)17/h2-4,7-8,13H,5-6,9-11H2,1H3,(H,16,17)
InChIKey ARICQTULAMMFRI-UHFFFAOYSA-N
Mol Weight 232.32 g/mol
Molecular Formula C15H20O2
Exact Mass 232.14633 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 13Phv70b59a
Name (2-Methyl-2-phenylcyclohexyl)acetic acid, (trans)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.146329882 u
Formula C15H20O2
InChI InChI=1S/C15H20O2/c1-15(12-7-3-2-4-8-12)10-6-5-9-13(15)11-14(16)17/h2-4,7-8,13H,5-6,9-11H2,1H3,(H,16,17)
InChIKey ARICQTULAMMFRI-UHFFFAOYSA-N
Molecular Weight 232.323 g/mol
SMILES C1=CC(=CC=C1)C1(C(CCCC1)CC(O)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.890535