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6-Methyl-1-phenyl-2,6-heptanediol
SpectraBase Compound ID 4v7N1KPhF11
InChI InChI=1S/C14H22O2/c1-14(2,16)10-6-9-13(15)11-12-7-4-3-5-8-12/h3-5,7-8,13,15-16H,6,9-11H2,1-2H3
InChIKey DKUXQPHSMOSVMZ-UHFFFAOYSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ARhXxiGOvqs
Name 6-Methyl-1-phenyl-2,6-heptanediol
CAS Registry Number 69815-09-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-14(2,16)10-6-9-13(15)11-12-7-4-3-5-8-12/h3-5,7-8,13,15-16H,6,9-11H2,1-2H3
InChIKey DKUXQPHSMOSVMZ-UHFFFAOYSA-N
Molecular Weight 222.328 g/mol
SMILES OC(CCCC(O)(C)C)Cc1ccccc1
SPLASH splash10-0006-9100000000-f865eb3e038648009737
Source of Spectrum NP-5-4362-0
Synonyms 2-Methyl-7-phenyl-2,6-heptanediol 6-Methyl-1-phenylheptane-2,6-diol
Wiley ID 1104869