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Benzenemethanol, 4-methyl-.alpha.-(1-methyl-2-propenyl)-, (R*,R*)-
SpectraBase Compound ID DfdETkmVWzO
InChI InChI=1S/C12H16O/c1-4-10(3)12(13)11-7-5-9(2)6-8-11/h4-8,10,12-13H,1H2,2-3H3
InChIKey SVRCCXVJDFUITE-UHFFFAOYSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4k8OvWyP4b5
Name Benzenemethanol, 4-methyl-.alpha.-(1-methyl-2-propenyl)-, (R*,R*)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 176.120115134 u
Formula C12H16O
InChI InChI=1S/C12H16O/c1-4-10(3)12(13)11-7-5-9(2)6-8-11/h4-8,10,12-13H,1H2,2-3H3
InChIKey SVRCCXVJDFUITE-UHFFFAOYSA-N
Molecular Weight 176.259 g/mol
SMILES CC1=CC=C(C(C(C)C=C)O)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.87425