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(E)-6-CHLORO-10,11-DEHYDROCURVULARIN
SpectraBase Compound ID 4wwSIUWNv6j
InChI InChI=1S/C16H17ClO5/c1-9-5-3-2-4-6-11(18)14-10(8-13(20)22-9)7-12(19)15(17)16(14)21/h4,6-7,9,19,21H,2-3,5,8H2,1H3/b6-4+/t9-/m0/s1
InChIKey UQSXUWXEMMUFMK-DNQSNQRASA-N
Mol Weight 324.76 g/mol
Molecular Formula C16H17ClO5
Exact Mass 324.076451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66F9got7ddi
Name 6-Chloro-10,11-dehydrocurvularin
Alternate Name(s) (5S,9E)-14-chloro-13,15-dihydroxy-5-methyl-4-oxabicyclo[10.4.0]hexadeca-1(16),9,12,14-tetraene-3,11-dione (5S,9E)-14-chloranyl-5-methyl-13,15-bis(oxidanyl)-4-oxabicyclo[10.4.0]hexadeca-1(16),9,12,14-tetraene-3,11-dione
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Formula C16H17ClO5
InChI InChI=1S/C16H17ClO5/c1-9-5-3-2-4-6-11(18)14-10(8-13(20)22-9)7-12(19)15(17)16(14)21/h4,6-7,9,19,21H,2-3,5,8H2,1H3/b6-4+/t9-/m0/s1
InChIKey UQSXUWXEMMUFMK-DNQSNQRASA-N
Molecular Weight 324.760 g/mol
SMILES Oc1cc2c(c(c1Cl)O)C(\C=C\CCC[C@@](OC(C2)=O)(C)[H])=O
SPLASH splash10-0bu0-4391000000-9b616f89139e14ac75ea
Source of Spectrum X2-56-2177-2
Wiley ID 1605281