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4,2,8-Ethanylylidene-2H-1-benzopyran-10-ol, 6-chloro-3,4,4a,5,8,8a-hexahydro-, acetate, (2.alpha.,4.alpha.,4a.beta.,8.alpha.,8a.beta.,9S*,10S*)-
SpectraBase Compound ID 5q7wJ9eVEX3
InChI InChI=1S/C13H15ClO3/c1-5(15)16-13-8-4-10-11(13)9-3-6(14)2-7(8)12(9)17-10/h3,7-13H,2,4H2,1H3/t7-,8-,9+,10-,11-,12+,13+/m0/s1
InChIKey GGHMKIVVZSPYLN-XDQOZGBTSA-N
Mol Weight 254.71 g/mol
Molecular Formula C13H15ClO3
Exact Mass 254.070972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G0ZDt9h3hdN
Name 4,2,8-Ethanylylidene-2H-1-benzopyran-10-ol, 6-chloro-3,4,4a,5,8,8a-hexahydro-, acetate, (2.alpha.,4.alpha.,4a.beta.,8.alpha.,8a.beta.,9S*,10S*)-
Alternate Name(s) 11-chloro-7-oxatetracyclo[6.4.0.0(2,6).0(4,9)]dodec-11-en-3-yl acetate [11-chloro-7-oxatetracyclo[6.4.0.0(2,6).0(4,9)]dodec-11-en-3endo-yl]ester of acetic acid
CAS Registry Number 78630-92-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15ClO3
InChI InChI=1S/C13H15ClO3/c1-5(15)16-13-8-4-10-11(13)9-3-6(14)2-7(8)12(9)17-10/h3,7-13H,2,4H2,1H3/t7-,8-,9+,10-,11-,12+,13+/m0/s1
InChIKey GGHMKIVVZSPYLN-XDQOZGBTSA-N
Molecular Weight 254.713 g/mol
SMILES [C@@]12([C@]3([C@]4([C@@](O2)(C[C@@]([C@@]1(CC(Cl)=C3)[H])([C@]4(OC(=O)C)[H])[H])[H])[H])[H])[H]
SPLASH splash10-002f-9400000000-ad2e1b3a3be81dab0bb1
Source of Spectrum H-64-1021-0
Wiley ID 1257463