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2-(t-Butyl)-1-phenylheptane-1,2-diol

View entire compound with spectra: 1 MS (GC)

2-(t-Butyl)-1-phenylheptane-1,2-diol
SpectraBase Compound ID 1Rl5iv2ouu3
InChI InChI=1S/C17H28O2/c1-5-6-10-13-17(19,16(2,3)4)15(18)14-11-8-7-9-12-14/h7-9,11-12,15,18-19H,5-6,10,13H2,1-4H3
InChIKey QVFOQUVTCXYIBJ-UHFFFAOYSA-N
Mol Weight 264.41 g/mol
Molecular Formula C17H28O2
Exact Mass 264.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H60ESSqgWMX
Name 2-(t-Butyl)-1-phenylheptane-1,2-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H28O2
InChI InChI=1S/C17H28O2/c1-5-6-10-13-17(19,16(2,3)4)15(18)14-11-8-7-9-12-14/h7-9,11-12,15,18-19H,5-6,10,13H2,1-4H3
InChIKey QVFOQUVTCXYIBJ-UHFFFAOYSA-N
Molecular Weight 264.409 g/mol
SMILES OC(C(O)c1ccccc1)(CCCCC)C(C)(C)C
SPLASH splash10-0a4i-9400000000-cc06098297b909ff1928
Source of Spectrum U1-1998-2166-14
Synonyms 2-tert-Butyl-1-phenyl-1,2-heptanediol
Wiley ID 751878