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2-(3,3-dimethylbut-1-ynyl)-4,4-dimethyl-1-cyclohex-2-enone
SpectraBase Compound ID 5N0eSG9l2TI
InChI InChI=1S/C14H20O/c1-13(2,3)8-6-11-10-14(4,5)9-7-12(11)15/h10H,7,9H2,1-5H3
InChIKey BVKHHUVEVXTMRX-UHFFFAOYSA-N
Mol Weight 204.31 g/mol
Molecular Formula C14H20O
Exact Mass 204.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3U95rKfvojF
Name 2-(3,3-dimethylbut-1-ynyl)-4,4-dimethyl-1-cyclohex-2-enone
Alternate Name(s) 2-(3,3-dimethylbut-1-ynyl)-4,4-dimethyl-cyclohex-2-en-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C14H20O
InChI InChI=1S/C14H20O/c1-13(2,3)8-6-11-10-14(4,5)9-7-12(11)15/h10H,7,9H2,1-5H3
InChIKey BVKHHUVEVXTMRX-UHFFFAOYSA-N
Molecular Weight 204.313 g/mol
SMILES C(C1=CC(C)(C)CCC1=O)#CC(C)(C)C
SPLASH splash10-0f79-0940000000-65ddfc1de8e22dc33259
Source of Spectrum J-59-5395-11
Wiley ID 1202422