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5-(2,2-Dimethyl-2H-chromen-3-yl)-5-hydroxy-3-oxopentanoic acid methyl ester
SpectraBase Compound ID 4eEtGwOpTk3
InChI InChI=1S/C17H20O5/c1-17(2)13(8-11-6-4-5-7-15(11)22-17)14(19)9-12(18)10-16(20)21-3/h4-8,14,19H,9-10H2,1-3H3
InChIKey WXLKTCHZFUBGGU-UHFFFAOYSA-N
Mol Weight 304.34 g/mol
Molecular Formula C17H20O5
Exact Mass 304.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IRLfERgreSJ
Name 5-(2,2-Dimethyl-2H-chromen-3-yl)-5-hydroxy-3-oxopentanoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O5
InChI InChI=1S/C17H20O5/c1-17(2)13(8-11-6-4-5-7-15(11)22-17)14(19)9-12(18)10-16(20)21-3/h4-8,14,19H,9-10H2,1-3H3
InChIKey WXLKTCHZFUBGGU-UHFFFAOYSA-N
Molecular Weight 304.342 g/mol
SMILES OC(CC(CC(=O)OC)=O)C=1C(Oc2c(C1)cccc2)(C)C
SPLASH splash10-00dr-0981000000-1894f9355c0644808737
Source of Spectrum G2-2002-1894-12
Synonyms Methyl 5-(2,2-dimethyl-2H-chromen-3-yl)-5-hydroxy-3-oxopentanoate
Wiley ID 1617826