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3-(Phenylmethylene)-2-methyl-2,5-pentanediol
SpectraBase Compound ID KACCqlEaKtq
InChI InChI=1S/C13H18O2/c1-13(2,15)12(8-9-14)10-11-6-4-3-5-7-11/h3-7,10,14-15H,8-9H2,1-2H3/b12-10-
InChIKey UMKAMPMZVRFHIY-BENRWUELSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IDsZN6DcAEF
Name 3-(Phenylmethylene)-2-methyl-2,5-pentanediol
Comments Less than 3 mono-isotopic peaks
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Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-13(2,15)12(8-9-14)10-11-6-4-3-5-7-11/h3-7,10,14-15H,8-9H2,1-2H3/b12-10-
InChIKey UMKAMPMZVRFHIY-BENRWUELSA-N
Molecular Weight 206.285 g/mol
SMILES OCC\C(C(C)(O)C)=C/c1ccccc1
SPLASH splash10-000i-0920000000-354327f18363f88a6361
Source of Spectrum SO-0-957-7
Synonyms (3Z)-3-benzylidene-4-methyl-1,4-pentanediol
Wiley ID 1541694