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(2S)-2',4'-dihydroxy-7-methoxy-8-prenylflavan
SpectraBase Compound ID Boom1iJaLl9
InChI InChI=1S/C21H24O4/c1-13(2)4-8-17-19(24-3)10-5-14-6-11-20(25-21(14)17)16-9-7-15(22)12-18(16)23/h4-5,7,9-10,12,20,22-23H,6,8,11H2,1-3H3/t20-/m0/s1
InChIKey OAUAVKGFNHNNGR-FQEVSTJZSA-N
Mol Weight 340.42 g/mol
Molecular Formula C21H24O4
Exact Mass 340.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4N21ynT7P4
Name (2S)-2',4'-dihydroxy-7-methoxy-8-prenylflavan
Appearance Brown powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O4
InChI InChI=1S/C21H24O4/c1-13(2)4-8-17-19(24-3)10-5-14-6-11-20(25-21(14)17)16-9-7-15(22)12-18(16)23/h4-5,7,9-10,12,20,22-23H,6,8,11H2,1-3H3/t20-/m0/s1
InChIKey OAUAVKGFNHNNGR-FQEVSTJZSA-N
Instrument Name Finnigan MAT 90
Ionization Type EI
Literature Reference DOI 10.1021/np010288l
Molecular Weight 340.419 g/mol
Optical Rotation [a]D20 = -5.2 (c = 0.25, MeOH)
SMILES Oc1c(ccc(c1)O)[C@]1(Oc2c(c(ccc2CC1)OC)CC=C(C)C)[H]
SPLASH splash10-01oy-0934000000-54842324bcff8586034b
Source of Spectrum G4-64-SM4-22
Wiley ID 1882900