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4,2,8-Ethanylylidene-2H-1-benzopyran-10-one, 6-chloro-3,4,4a,7,8,8a-hexahydro-7-hydroxy-, (2.alpha.,4.alpha.,4a.beta.,7.beta.,8.alpha.,8a.beta.,9R*)-
SpectraBase Compound ID EGBg9lhUuyC
InChI InChI=1S/C11H11ClO3/c12-5-1-4-3-2-6-7(9(3)13)8(10(5)14)11(4)15-6/h1,3-4,6-8,10-11,14H,2H2/t3-,4-,6-,7+,8-,10-,11+/m1/s1
InChIKey DCUTYYDYTJLJIU-WORUEZNZSA-N
Mol Weight 226.66 g/mol
Molecular Formula C11H11ClO3
Exact Mass 226.039672 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJBJd1dehmr
Name 4,2,8-Ethanylylidene-2H-1-benzopyran-10-one, 6-chloro-3,4,4a,7,8,8a-hexahydro-7-hydroxy-, (2.alpha.,4.alpha.,4a.beta.,7.beta.,8.alpha.,8a.beta.,9R*)-
CAS Registry Number 78630-84-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11ClO3
InChI InChI=1S/C11H11ClO3/c12-5-1-4-3-2-6-7(9(3)13)8(10(5)14)11(4)15-6/h1,3-4,6-8,10-11,14H,2H2/t3-,4-,6-,7+,8-,10-,11+/m1/s1
InChIKey DCUTYYDYTJLJIU-WORUEZNZSA-N
Molecular Weight 226.659 g/mol
SMILES O[C@]1([C@]2([C@@]3([C@]4(C[C@]([C@]([C@@]2(O4)[H])(C=C1Cl)[H])(C3=O)[H])[H])[H])[H])[H]
SPLASH splash10-001i-9300000000-5dda6ce5c423200e7b22
Source of Spectrum H-64-1019-0
Synonyms 11-chloro-12-hydroxy-7-oxatetracyclo[6.4.0.0(2,6).0(4,9)]dodec-10-en-3-one 11-Chloro-12exo-hydroxy-7-oxatetracyclo[6.4.0.0(2,6).0(4,9)]dodec-10-en-3-one 4,2,8-Ethanylylidene-2H-1-benzopyran-10-one, 6-chloro-3,4,4a,7,8,8a-hexahydro-7- 4,2,8-Ethanylylidene-2H-1-benzopyran-10-one, 6-chloro-3,4,4a,7,8,8a-hexahydro-7-hydroxy-, (2.alpha.,4.alpha.,4a.beta.,7.beta.,8.alpha.,8 a.beta.,9R@)- 4,2,8-Ethanylylidene-2H-1-benzopyran-10-one, 6-chloro-3,4,4a,7,8,8a-hexahydro-7-hydroxy-, (2alpha,4alpha,4abeta,7beta,8alpha,8 abeta,9R*)-
Wiley ID 1226981