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KARENIN
SpectraBase Compound ID 6TzL7xU5bxS
InChI InChI=1S/C15H14O5/c1-8-2-3-10-12(19-7-8)5-13-14(15(10)18)11(17)4-9(6-16)20-13/h2,4-5,16,18H,3,6-7H2,1H3
InChIKey LMFRELDATPGFFD-UHFFFAOYSA-N
Mol Weight 274.27 g/mol
Molecular Formula C15H14O5
Exact Mass 274.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JNtrWF9j6mg
Name 4H-Pyrano[3,2-h][1]benzoxepin-4-one, 6,9-dihydro-5-hydroxy-2-(hydroxymethyl)-8-methyl-
Alternate Name(s) 5-Hydroxy-2-(hydroxymethyl)-8-methyl-6,9-dihydro-4H-oxepino[3,2-g]chromen-4-one Karenin 5-Hydroxy-2-(hydroxymethyl)-8-methyl-6,9-dihydropyrano[3,2-h][1]benzoxepin-4-one 2-(hydroxymethyl)-8-methyl-5-oxidanyl-6,9-dihydropyrano[3,2-h][1]benzoxepin-4-one
CAS Registry Number 13544-38-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14O5
InChI InChI=1S/C15H14O5/c1-8-2-3-10-12(19-7-8)5-13-14(15(10)18)11(17)4-9(6-16)20-13/h2,4-5,16,18H,3,6-7H2,1H3
InChIKey LMFRELDATPGFFD-UHFFFAOYSA-N
Molecular Weight 274.272 g/mol
SMILES OCC1=CC(c2c(c3CC=C(COc3cc2O1)C)O)=O
SPLASH splash10-0a4i-0090000000-4832274d84f57682c0c4
Source of Spectrum AD-0-348-0
Wiley ID 1278024