(3aR,5S,9bR)-9-chloranyl-6-methoxy-5-methyl-3,3a,5,9b-tetrahydrofuro[3,2-c]isochromen-2-one

SpectraBase Compound ID	Bttec8IHXkN
InChI	InChI=1S/C13H13ClO4/c1-6-11-8(16-2)4-3-7(14)12(11)13-9(17-6)5-10(15)18-13/h3-4,6,9,13H,5H2,1-2H3/t6-,9+,13-/m0/s1
InChIKey	ICHGRKAUSYRBKH-APIRENEASA-N Google Search
Mol Weight	268.7 g/mol
Molecular Formula	C13H13ClO4
Exact Mass	268.050237 g/mol

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SpectraBase Spectrum ID	3EGLJFY52rD
Name	(3aR,5S,9bR)-9-chloranyl-6-methoxy-5-methyl-3,3a,5,9b-tetrahydrofuro[3,2-c]isochromen-2-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H13ClO4
InChI	InChI=1S/C13H13ClO4/c1-6-11-8(16-2)4-3-7(14)12(11)13-9(17-6)5-10(15)18-13/h3-4,6,9,13H,5H2,1-2H3/t6-,9+,13-/m0/s1
InChIKey	ICHGRKAUSYRBKH-APIRENEASA-N
Molecular Weight	268.696 g/mol
SMILES	c12[C@@]3([C@](CC(O3)=O)([H])O[C@](c1c(OC)ccc2Cl)(C)[H])[H]
SPLASH	splash10-0udi-0190000000-6bbadf25c97b0ebfb5c6
Source of Spectrum	KC-0-3955-27
Synonyms	(3aR,5S,9bR)-9-chloro-6-methoxy-5-methyl-3,3a,5,9b-tetrahydrofuro[3,2-c]isochromen-2-one (3aR,5S,9bR)-9-chloro-6-methoxy-5-methyl-3,3a,5,9b-tetrahydrofuro[3,2-c][2]benzopyran-2-one (3aR,5S,9bR)-9-chloro-6-methoxy-5-methyl-3,3a,5,9b-tetrahydrofur[3,2-c]isochromen-2-one
Wiley ID	827106