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2H-Pyran-2-propanol, 4-butyl-5,6-dihydro-2-methyl-

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

2H-Pyran-2-propanol, 4-butyl-5,6-dihydro-2-methyl-
SpectraBase Compound ID GIMhhJSJ8Hj
InChI InChI=1S/C13H24O2/c1-3-4-6-12-7-10-15-13(2,11-12)8-5-9-14/h11,14H,3-10H2,1-2H3
InChIKey MBCYHTGAMWEMST-UHFFFAOYSA-N
Mol Weight 212.33 g/mol
Molecular Formula C13H24O2
Exact Mass 212.17763 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IQityH1YjWC
Name 2H-Pyran-2-propanol, 4-butyl-5,6-dihydro-2-methyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 212.177630011 u
Formula C13H24O2
InChI InChI=1S/C13H24O2/c1-3-4-6-12-7-10-15-13(2,11-12)8-5-9-14/h11,14H,3-10H2,1-2H3
InChIKey MBCYHTGAMWEMST-UHFFFAOYSA-N
Molecular Weight 212.333 g/mol
SMILES C=1C(OCCC1CCCC)(CCCO)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.942978