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1-(2-Hydroxyphenyl)-5-methyl-1-hexanone
SpectraBase Compound ID 1aGTQ2NIRJW
InChI InChI=1S/C13H18O2/c1-10(2)6-5-9-13(15)11-7-3-4-8-12(11)14/h3-4,7-8,10,14H,5-6,9H2,1-2H3
InChIKey CVZFDPNMOXTCLU-UHFFFAOYSA-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 Bdk99soVlIS
Name 1-(2-Hydroxyphenyl)-5-methyl-1-hexanone
Classification Alkyl-phenylketones
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 206.130679818 u
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-10(2)6-5-9-13(15)11-7-3-4-8-12(11)14/h3-4,7-8,10,14H,5-6,9H2,1-2H3
InChIKey CVZFDPNMOXTCLU-UHFFFAOYSA-N
Molecular Weight 206.285 g/mol
Number of Peaks 18
SMILES Oc1c(cccc1)C(CCCC(C)C)=O
SPLASH splash10-00di-1900000000-26aecca2872d1a1301d8
Source of Spectrum FF-29-79-7 (DOI: 10.1002/ffj.3182)
Synonyms 1-(2-hydroxyphenyl)-5-methylhexan-1-one
Wiley ID 1775684