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6,7-Dimethoxy-1-methylisochroman-1-carboxylic acid
SpectraBase Compound ID 2HlZNz8cO2K
InChI InChI=1S/C13H16O5/c1-13(12(14)15)9-7-11(17-3)10(16-2)6-8(9)4-5-18-13/h6-7H,4-5H2,1-3H3,(H,14,15)
InChIKey MFPSUBOYOOMEQE-UHFFFAOYSA-N
Mol Weight 252.27 g/mol
Molecular Formula C13H16O5
Exact Mass 252.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AVESozHgEv2
Name 6,7-Dimethoxy-1-methylisochroman-1-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O5
InChI InChI=1S/C13H16O5/c1-13(12(14)15)9-7-11(17-3)10(16-2)6-8(9)4-5-18-13/h6-7H,4-5H2,1-3H3,(H,14,15)
InChIKey MFPSUBOYOOMEQE-UHFFFAOYSA-N
Molecular Weight 252.266 g/mol
SMILES OC(C1(c2cc(OC)c(cc2CCO1)OC)C)=O
SPLASH splash10-0a4i-0190000000-8607af2cf014c19b34c7
Source of Spectrum D8-328-183-4
Synonyms 6,7-Dimethoxy-1-methyl-3,4-dihydro-1H-2-benzopyran-1-carboxylic acid 6,7-Dimethoxy-1-methylisochroman-2-carboxylic acid
Wiley ID 1515706