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3,4-Dihydro-6-(5-chloro-2-hydroxy-4-methylbenzoyl)-2H-chromene-8-carboxylic acid
SpectraBase Compound ID 5EvdelaniSY
InChI InChI=1S/C18H15ClO5/c1-9-5-15(20)12(8-14(9)19)16(21)11-6-10-3-2-4-24-17(10)13(7-11)18(22)23/h5-8,20H,2-4H2,1H3,(H,22,23)
InChIKey RIECOASFEZQIBF-UHFFFAOYSA-N
Mol Weight 346.77 g/mol
Molecular Formula C18H15ClO5
Exact Mass 346.060801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 89cQjm6fs6m
Name 3,4-Dihydro-6-(5-chloro-2-hydroxy-4-methylbenzoyl)-2H-chromene-8-carboxylic acid
Alternate Name(s) 6-(5-Chloro-2-hydroxy-4-methylbenzoyl)-8-chromanecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15ClO5
InChI InChI=1S/C18H15ClO5/c1-9-5-15(20)12(8-14(9)19)16(21)11-6-10-3-2-4-24-17(10)13(7-11)18(22)23/h5-8,20H,2-4H2,1H3,(H,22,23)
InChIKey RIECOASFEZQIBF-UHFFFAOYSA-N
Molecular Weight 346.766 g/mol
SMILES OC(c1c2OCCCc2cc(C(c2c(cc(c(c2)Cl)C)O)=O)c1)=O
SPLASH splash10-01ta-2903000000-ce290f53f0ecaabcc03f
Source of Spectrum F-62-7685-11
Wiley ID 1640318