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4-Methyl-2-phenyl-1,4-pentanediol

View entire compound with spectra: 2 MS (GC)

4-Methyl-2-phenyl-1,4-pentanediol
SpectraBase Compound ID Emvtq7fh7XR
InChI InChI=1S/C12H18O2/c1-12(2,14)8-11(9-13)10-6-4-3-5-7-10/h3-7,11,13-14H,8-9H2,1-2H3
InChIKey KAYRIUWOKNWUIR-UHFFFAOYSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AX6jLTNjGIy
Name 4-Methyl-2-phenyl-1,4-pentanediol
Alternate Name(s) 1,4-Pentanediol, 4-methyl-2-phenyl- 4-Methyl-2-phenyl-pentane-1,4-diol
CAS Registry Number 132781-85-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-12(2,14)8-11(9-13)10-6-4-3-5-7-10/h3-7,11,13-14H,8-9H2,1-2H3
InChIKey KAYRIUWOKNWUIR-UHFFFAOYSA-N
Molecular Weight 194.274 g/mol
SMILES OCC(CC(C)(C)O)c1ccccc1
SPLASH splash10-0a6r-9800000000-29c4ec83e53b96fd0e4d
Wiley ID 1487061