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(S)-8-O-Methylmellein
SpectraBase Compound ID 95AgiqY9RMc
InChI InChI=1S/C11H12O3/c1-7-6-8-4-3-5-9(13-2)10(8)11(12)14-7/h3-5,7H,6H2,1-2H3/t7-/m0/s1
InChIKey AYIDXPPINFIJKW-ZETCQYMHSA-N
Mol Weight 192.21 g/mol
Molecular Formula C11H12O3
Exact Mass 192.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HHR7dl3q4Jl
Name (S)-8-O-Methylmellein
Alternate Name(s) (3S)-8-methoxy-3-methyl-3,4-dihydro-1H-2-benzopyran-1-one (3S)-8-methoxy-3-methyl-3,4-dihydroisochromen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O3
InChI InChI=1S/C11H12O3/c1-7-6-8-4-3-5-9(13-2)10(8)11(12)14-7/h3-5,7H,6H2,1-2H3/t7-/m0/s1
InChIKey AYIDXPPINFIJKW-ZETCQYMHSA-N
Molecular Weight 192.214 g/mol
SMILES C1(c2c(cccc2OC)C[C@@](O1)(C)[H])=O
SPLASH splash10-0007-5900000000-87d7986d2de2196dbfab
Source of Spectrum SO-0-2048-1
Wiley ID 877225