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1-Allyl-3-(cyclohex-1-enyl)-1H-isochromene
SpectraBase Compound ID 6VT576GDULd
InChI InChI=1S/C18H20O/c1-2-8-17-16-12-7-6-11-15(16)13-18(19-17)14-9-4-3-5-10-14/h2,6-7,9,11-13,17H,1,3-5,8,10H2
InChIKey MWQXSZJRWGQOQB-UHFFFAOYSA-N
Mol Weight 252.36 g/mol
Molecular Formula C18H20O
Exact Mass 252.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JaNWiMaf7el
Name 1-Allyl-3-(cyclohex-1-enyl)-1H-isochromene
Comments Less than 3 mono-isotopic peaks
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Formula C18H20O
InChI InChI=1S/C18H20O/c1-2-8-17-16-12-7-6-11-15(16)13-18(19-17)14-9-4-3-5-10-14/h2,6-7,9,11-13,17H,1,3-5,8,10H2
InChIKey MWQXSZJRWGQOQB-UHFFFAOYSA-N
Molecular Weight 252.357 g/mol
SMILES C=1(OC(CC=C)c2c(C1)cccc2)C1=CCCCC1
SPLASH splash10-03di-0090000000-ff9287b7c658b8ae3266
Source of Spectrum KC-61-11325-2
Synonyms 1-allyl-3-(1-cyclohexen-1-yl)-1H-2-benzopyran
Wiley ID 1631355