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4'-O-Hexanoylglycitein
SpectraBase Compound ID Hw3O8BOz3gJ
InChI InChI=1S/C22H22O6/c1-3-4-5-6-21(24)28-15-9-7-14(8-10-15)17-13-27-19-12-18(23)20(26-2)11-16(19)22(17)25/h7-13,23H,3-6H2,1-2H3
InChIKey LVNJZJYMPVSFHS-UHFFFAOYSA-N
Mol Weight 382.41 g/mol
Molecular Formula C22H22O6
Exact Mass 382.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tlr6RWaVdq
Name 4'-O-Hexanoylglycitein
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22O6
InChI InChI=1S/C22H22O6/c1-3-4-5-6-21(24)28-15-9-7-14(8-10-15)17-13-27-19-12-18(23)20(26-2)11-16(19)22(17)25/h7-13,23H,3-6H2,1-2H3
InChIKey LVNJZJYMPVSFHS-UHFFFAOYSA-N
Molecular Weight 382.412 g/mol
SMILES Oc1cc2OC=C(C(c2cc1OC)=O)c1ccc(OC(=O)CCCCC)cc1
SPLASH splash10-001i-0091000000-3384be40efcdfd653a1c
Source of Spectrum U1-2008-5625-6c
Wiley ID 1662238