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3-Hepten-2-one, 6-methyl-6-(3-methyl-2H-pyran-6-yl)-, (Z)-
SpectraBase Compound ID 9x3dYfITIlK
InChI InChI=1S/C14H20O2/c1-11-7-8-13(16-10-11)14(3,4)9-5-6-12(2)15/h5-8H,9-10H2,1-4H3/b6-5-
InChIKey ATGBJMLAUQKLRX-WAYWQWQTSA-N
Mol Weight 220.31 g/mol
Molecular Formula C14H20O2
Exact Mass 220.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3Hpvo4lUHY
Name 3-Hepten-2-one, 6-methyl-6-(3-methyl-2H-pyran-6-yl)-, (Z)-
CAS Registry Number 88354-50-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O2
InChI InChI=1S/C14H20O2/c1-11-7-8-13(16-10-11)14(3,4)9-5-6-12(2)15/h5-8H,9-10H2,1-4H3/b6-5-
InChIKey ATGBJMLAUQKLRX-WAYWQWQTSA-N
Molecular Weight 220.312 g/mol
SMILES C=1(OCC(=CC1)C)C(C\C=C/C(=O)C)(C)C
SPLASH splash10-006x-9700000000-26dd33ba0df751d30c5e
Source of Spectrum H-66-1649-0
Synonyms (Z)-6-methyl-6-(3-methyl-2H-pyran-6-yl)-3-hepten-2-one (Z)-6-methyl-6-(3-methyl-2H-pyran-6-yl)hept-3-en-2-one
Wiley ID 1220080