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5-Chloro-8-hydroxy-6-methoxy-3-methylisochroman-1-one
SpectraBase Compound ID EXIDP3cgchC
InChI InChI=1S/C11H11ClO4/c1-5-3-6-9(11(14)16-5)7(13)4-8(15-2)10(6)12/h4-5,13H,3H2,1-2H3
InChIKey WLUQQWRUOSZKGN-UHFFFAOYSA-N
Mol Weight 242.66 g/mol
Molecular Formula C11H11ClO4
Exact Mass 242.034587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1tptq6RZ3Se
Name 5-Chloro-8-hydroxy-6-methoxy-3-methylisochroman-1-one
Alternate Name(s) 5-Chloro-8-hydroxy-6-methoxy-3-methyl-3,4-dihydro-1H-2-benzopyran-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11ClO4
InChI InChI=1S/C11H11ClO4/c1-5-3-6-9(11(14)16-5)7(13)4-8(15-2)10(6)12/h4-5,13H,3H2,1-2H3
InChIKey WLUQQWRUOSZKGN-UHFFFAOYSA-N
Molecular Weight 242.658 g/mol
SMILES Oc1cc(c(c2CC(OC(c12)=O)C)Cl)OC
SPLASH splash10-0006-0190000000-5f87e9f641604ff260b8
Source of Spectrum JX-2015-6-11968
Wiley ID 1731137