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2,4,4,5-tetramethyl-3-[(E)-3-oxidanylidenebut-1-enyl]cyclohex-2-en-1-one
SpectraBase Compound ID 1LKKvQ0jqET
InChI InChI=1S/C14H20O2/c1-9-8-13(16)11(3)12(14(9,4)5)7-6-10(2)15/h6-7,9H,8H2,1-5H3/b7-6+
InChIKey KEIPKMLOEISKCN-VOTSOKGWSA-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 GsNCE4rz51Q
Name 2,4,4,5-tetramethyl-3-[(E)-3-oxidanylidenebut-1-enyl]cyclohex-2-en-1-one
CAS Registry Number 68931-35-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O2
InChI InChI=1S/C14H20O2/c1-9-8-13(16)11(3)12(14(9,4)5)7-6-10(2)15/h6-7,9H,8H2,1-5H3/b7-6+
InChIKey KEIPKMLOEISKCN-VOTSOKGWSA-N
Molecular Weight 220.312 g/mol
SMILES C1(=C(C(=O)CC(C1(C)C)C)C)\C=C\C(=O)C
SPLASH splash10-0076-6910000000-ace95d14daa84c341331
Source of Spectrum H-72-1411-13
Synonyms 2,4,4,5-tetramethyl-3-[(E)-3-oxobut-1-enyl]-1-cyclohex-2-enone 2-Cyclohexen-1-one, 2,4,4,5-tetramethyl-3-(3-oxo-1-butenyl)- 2,4,4,5-Tetramethyl-3-[(E)-3-oxobut-1-enyl]cyclohex-2-en-1-one 3-[(E)-3-ketobut-1-enyl]-2,4,4,5-tetramethyl-cyclohex-2-en-1-one
Wiley ID 1220095