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2-Heptylidenecyclopentanone
SpectraBase Compound ID 8lsigh0UgBW
InChI InChI=1S/C12H20O/c1-2-3-4-5-6-8-11-9-7-10-12(11)13/h8H,2-7,9-10H2,1H3/b11-8+
InChIKey PBNMXJOZTAVFCR-DHZHZOJOSA-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 JFs6YeizvCR
Name 2-Heptylidenecyclopentanone
Alternate Name(s) (2E)-2-heptylidene-1-cyclopentanone (2E)-2-heptylidenecyclopentan-1-one (2E)-2-heptylidenecyclopentanone
Comments Less than 3 mono-isotopic peaks
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Formula C12H20O
InChI InChI=1S/C12H20O/c1-2-3-4-5-6-8-11-9-7-10-12(11)13/h8H,2-7,9-10H2,1H3/b11-8+
InChIKey PBNMXJOZTAVFCR-DHZHZOJOSA-N
Molecular Weight 180.291 g/mol
SMILES C1(\C(CCC1)=C\CCCCCC)=O
SPLASH splash10-00di-0900000000-71893c553f31e5d266fd
Source of Spectrum J-61-5389-26
Wiley ID 1177002