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2-iodomethyl-5-methoxy-4-(prop-2'-enyl)-2,3-dihydroanthra[1,2-b]furan-6,11-dione
SpectraBase Compound ID 70fmPppsrpo
InChI InChI=1S/C21H17IO4/c1-3-6-14-15-9-11(10-22)26-21(15)17-16(20(14)25-2)18(23)12-7-4-5-8-13(12)19(17)24/h3-8,11H,9-10H2,1-2H3/b6-3+
InChIKey NUSSZLSVIAPGHO-ZZXKWVIFSA-N
Mol Weight 460.27 g/mol
Molecular Formula C21H17IO4
Exact Mass 460.017154 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ct6xTQhWjLz
Name 2-iodomethyl-5-methoxy-4-(prop-2'-enyl)-2,3-dihydroanthra[1,2-b]furan-6,11-dione
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Formula C21H17IO4
InChI InChI=1S/C21H17IO4/c1-3-6-14-15-9-11(10-22)26-21(15)17-16(20(14)25-2)18(23)12-7-4-5-8-13(12)19(17)24/h3-8,11H,9-10H2,1-2H3/b6-3+
InChIKey NUSSZLSVIAPGHO-ZZXKWVIFSA-N
Molecular Weight 460.267 g/mol
SMILES c12c(C(=O)c3c(C2=O)cccc3)c(OC)c(c2c1OC(CI)C2)\C=C\C
SPLASH splash10-03di-0002900000-8cb9509bf96cb29666a3
Source of Spectrum B-47-1561-0
Synonyms 2-(iodomethyl)-5-methoxy-4-[(1E)-1-propenyl]-2,3-dihydroanthra[1,2-b]furan-6,11-dione
Wiley ID 1390407