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8-chloranyl-2,7-dimethyl-2-[(1E)-4-methylpenta-1,3-dienyl]-5-oxidanyl-chromene-6-carbaldehyde
SpectraBase Compound ID 5fcbkoty2Ba
InChI InChI=1S/C18H19ClO3/c1-11(2)6-5-8-18(4)9-7-13-16(21)14(10-20)12(3)15(19)17(13)22-18/h5-10,21H,1-4H3/b8-5+
InChIKey YTJQHLPNJRYMEU-VMPITWQZSA-N
Mol Weight 318.8 g/mol
Molecular Formula C18H19ClO3
Exact Mass 318.102272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnG7zzYBbkZ
Name 8-chloranyl-2,7-dimethyl-2-[(1E)-4-methylpenta-1,3-dienyl]-5-oxidanyl-chromene-6-carbaldehyde
Alternate Name(s) 8-chloro-5-hydroxy-2,7-dimethyl-2-[(1E)-4-methylpenta-1,3-dienyl]-1-benzopyran-6-carboxaldehyde 8-chloro-5-hydroxy-2,7-dimethyl-2-[(1E)-4-methylpenta-1,3-dienyl]chromene-6-carbaldehyde
Comments Less than 3 mono-isotopic peaks
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Formula C18H19ClO3
InChI InChI=1S/C18H19ClO3/c1-11(2)6-5-8-18(4)9-7-13-16(21)14(10-20)12(3)15(19)17(13)22-18/h5-10,21H,1-4H3/b8-5+
InChIKey YTJQHLPNJRYMEU-VMPITWQZSA-N
Molecular Weight 318.800 g/mol
SMILES Oc1c2c(c(c(c1C=O)C)Cl)OC(C=C2)(\C=C\C=C(C)C)C
SPLASH splash10-0uxr-0009000000-bf6593fa92285cf1b1b8
Source of Spectrum AJ-67-1184-32
Wiley ID 772677