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2-Cyclohexen-1-one, 2-hydroxy-6-methyl-3-(1-methylethyl)-
SpectraBase Compound ID DLADOIzQ9Y3
InChI InChI=1S/C10H16O2/c1-6(2)8-5-4-7(3)9(11)10(8)12/h6-7,12H,4-5H2,1-3H3
InChIKey POVACFJTDXZOQT-UHFFFAOYSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Li3XXdshamO
Name 2-Cyclohexen-1-one, 2-hydroxy-6-methyl-3-(1-methylethyl)-
CAS Registry Number 54783-36-7
Classification Menthane monoterpenoids
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 168.115029753 u
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-6(2)8-5-4-7(3)9(11)10(8)12/h6-7,12H,4-5H2,1-3H3
InChIKey POVACFJTDXZOQT-UHFFFAOYSA-N
Molecular Weight 168.236 g/mol
Number of Peaks 24
SMILES OC1=C(C(C)C)CCC(C1=O)C
SPLASH splash10-00or-4900000000-881cd66dccc74ba9d200
Source of Spectrum FF-19-376-2d' (DOI: 10.1002/ffj.1371)
Synonyms 2-Hydroxy-3-isopropyl-6-methyl-2-cyclohexen-1-one 2-Hydroxy-3-isopropyl-6-methyl-cyclohex-2-en-1-one 2-Hydroxy-6-methyl-3-propan-2-yl-1-cyclohex-2-enone 2-Hydroxy-3-isopropyl-6-methylcyclohex-2-en-1-one 2-Hydroxy-6-methyl-3-propan-2-ylcyclohex-2-en-1-one 6-Methyl-2-oxidanyl-3-propan-2-yl-cyclohex-2-en-1-one Xi-Diosphenol 2-Hydroxy-3-isopropyl-6-methylcyclohex-2-enone EINECS 259-345-2
Wiley ID 1775360