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2-Methyl-3-propylinden-1-one
SpectraBase Compound ID 2Td7Eo8RiQT
InChI InChI=1S/C13H14O/c1-3-6-10-9(2)13(14)12-8-5-4-7-11(10)12/h4-5,7-8H,3,6H2,1-2H3
InChIKey QXFXPAGCKMRJJX-UHFFFAOYSA-N
Mol Weight 186.25 g/mol
Molecular Formula C13H14O
Exact Mass 186.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JxT34qd70DS
Name 2-Methyl-3-propylinden-1-one
Alternate Name(s) 2-methyl-3-propyl-1-indenone
Comments Less than 3 mono-isotopic peaks
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Formula C13H14O
InChI InChI=1S/C13H14O/c1-3-6-10-9(2)13(14)12-8-5-4-7-11(10)12/h4-5,7-8H,3,6H2,1-2H3
InChIKey QXFXPAGCKMRJJX-UHFFFAOYSA-N
Molecular Weight 186.254 g/mol
SMILES C1(=C(c2ccccc2C1=O)CCC)C
SPLASH splash10-0079-0900000000-64c782336edc4de1014e
Source of Spectrum J-58-2803-22
Wiley ID 1183461