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4-ethyl-2-methyl-5-n-propylcyclohex-2-en-1-one
SpectraBase Compound ID BLSZ7xLygwP
InChI InChI=1S/C12H20O/c1-4-6-11-8-12(13)9(3)7-10(11)5-2/h7,10-11H,4-6,8H2,1-3H3
InChIKey RBQWWSZHVWCQTM-UHFFFAOYSA-N
Mol Weight 180.29 g/mol
Molecular Formula C12H20O
Exact Mass 180.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8aqRdUE0mLV
Name 4-ethyl-2-methyl-5-n-propylcyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O
InChI InChI=1S/C12H20O/c1-4-6-11-8-12(13)9(3)7-10(11)5-2/h7,10-11H,4-6,8H2,1-3H3
InChIKey RBQWWSZHVWCQTM-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 180.291 g/mol
SMILES C1(C(=CC(C(C1)CCC)CC)C)=O
SPLASH splash10-0a4j-9600000000-20fad8a1023d3b863740
Sample Comments Mixture of isomers
Source of Spectrum CN103535678A
Wiley ID 1848045