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(2E,4Z)-4-Isopropyl-7-methylocta-2,4-dienal
SpectraBase Compound ID CZRYgYxmBf8
InChI InChI=1S/C12H20O/c1-10(2)7-8-12(11(3)4)6-5-9-13/h5-6,8-11H,7H2,1-4H3/b6-5+,12-8+
InChIKey BRKATNPPYNUNQQ-DOQHAEMYSA-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 Y96JhJEHAV
Name (2E,4Z)-4-Isopropyl-7-methylocta-2,4-dienal
Appearance Yellow oil
Carrier Gas Hydrogen
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Formula C12H20O
InChI InChI=1S/C12H20O/c1-10(2)7-8-12(11(3)4)6-5-9-13/h5-6,8-11H,7H2,1-4H3/b6-5+,12-8+
InChIKey BRKATNPPYNUNQQ-DOQHAEMYSA-N
Instrument Name Agilent 5975C-7890A
Ionization Type EI
Literature Reference DOI 10.1002/cctc.202200671
Molecular Weight 180.291 g/mol
Reported Formula C12H20O
SMILES C(C)(C)\C(\C=C\C=O)=C\CC(C)C
SPLASH splash10-00di-8900000000-083f42fbee30a0fc1218
Source of Spectrum CCC-14-SM12-(2E,4Z)-1e
Wiley ID 1876104