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NRRJELAIXYYALW-UHFFFAOYSA-N
SpectraBase Compound ID F8MGA9ZkpJC
InChI InChI=1S/C20H15ClO4/c1-10(21)9-20(24)14-6-4-3-5-13(14)18(23)16-15(22)8-12-7-11(2)25-19(12)17(16)20/h3-8,22,24H,1,9H2,2H3
InChIKey NRRJELAIXYYALW-UHFFFAOYSA-N
Mol Weight 354.79 g/mol
Molecular Formula C20H15ClO4
Exact Mass 354.065887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1VGJq9ndDuU
Name 2-Methyl-5,11-dihydroxy-11-(2-chloropropenyl)furano[2,3-a]anthracen-6-one
Alternate Name(s) 11-[(1Z)-2-chloro-1-propenyl]-5,11-dihydroxy-2-methylanthra[1,2-b]furan-6(11H)-one 2-Methyl-5,11-dihydroxy-11-(2-chloro-allyl)furano[2,3-a]anthracen-6-one
Comments Less than 3 mono-isotopic peaks
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Formula C20H15ClO4
InChI InChI=1S/C20H15ClO4/c1-10(21)9-20(24)14-6-4-3-5-13(14)18(23)16-15(22)8-12-7-11(2)25-19(12)17(16)20/h3-8,22,24H,1,9H2,2H3
InChIKey NRRJELAIXYYALW-UHFFFAOYSA-N
Molecular Weight 354.789 g/mol
SMILES OC1(c2c(c(cc3c2oc(c3)C)O)C(c2ccccc12)=O)CC(=C)Cl
SPLASH splash10-004i-0090000000-3528d1dee853f2cb0d27
Source of Spectrum JA-50-379-26
Wiley ID 1344534