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Phebaclavin B
SpectraBase Compound ID ExwGzVFB2Py
InChI InChI=1S/C16H16O6/c1-9(15(18)21-3)4-5-11-8-10-6-7-12(17)14(20-2)13(10)22-16(11)19/h4,6-8,17H,5H2,1-3H3/b9-4+
InChIKey VOYTXVCFUOMPAS-RUDMXATFSA-N
Mol Weight 304.3 g/mol
Molecular Formula C16H16O6
Exact Mass 304.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JzlufcG5TmV
Name Phebaclavin B
Alternate Name(s) 8-Methoxy-7-hydroxy-3-[3'-(methoxycarbonyl)-2'-butenyl]-benzopyran-2(2H)-one Methyl (2E)-4-(7-hydroxy-8-methoxy-2-oxo-2H-chromen-3-yl)-2-methyl-2-butenoate (E)-4-(7-hydroxy-8-methoxy-2-oxo-1-benzopyran-3-yl)-2-methyl-2-butenoic acid methyl ester Methyl (E)-4-(7-hydroxy-8-methoxy-2-oxochromen-3-yl)-2-methylbut-2-enoate Methyl (E)-4-(7-hydroxy-8-methoxy-2-oxo-chromen-3-yl)-2-methyl-but-2-enoate Methyl (E)-4-(8-methoxy-7-oxidanyl-2-oxidanylidene-chromen-3-yl)-2-methyl-but-2-enoate
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Formula C16H16O6
InChI InChI=1S/C16H16O6/c1-9(15(18)21-3)4-5-11-8-10-6-7-12(17)14(20-2)13(10)22-16(11)19/h4,6-8,17H,5H2,1-3H3/b9-4+
InChIKey VOYTXVCFUOMPAS-RUDMXATFSA-N
Molecular Weight 304.298 g/mol
SMILES Oc1ccc2C=C(C(Oc2c1OC)=O)C\C=C/(C)C(=O)OC
SPLASH splash10-0006-0093000000-ee0fb51a8111d04ca196
Source of Spectrum G4-65-460-2
Wiley ID 1639403