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.beta.-D-Glucopyranoside, 3-(4-methoxyphenyl)-2-propenyl
SpectraBase Compound ID CiVHEajl6Ee
InChI InChI=1S/C16H22O7/c1-21-11-6-4-10(5-7-11)3-2-8-22-16-15(20)14(19)13(18)12(9-17)23-16/h2-7,12-20H,8-9H2,1H3/b3-2-/t12-,13-,14+,15-,16-/m1/s1
InChIKey XRQSXJGKRJVWSU-JNDSXIQISA-N
Mol Weight 326.34 g/mol
Molecular Formula C16H22O7
Exact Mass 326.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Gra2KuenuS
Name .beta.-D-Glucopyranoside, 3-(4-methoxyphenyl)-2-propenyl
Alternate Name(s) Vimalin (2Z)-3-(4-methoxyphenyl)-2-propenyl .beta.-D-glucopyranoside (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-(((Z)-3-(4-methoxyphenyl)allyl)oxy)tetrahydro-2H-pyran-3,4,5-triol
CAS Registry Number 19764-36-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O7
InChI InChI=1S/C16H22O7/c1-21-11-6-4-10(5-7-11)3-2-8-22-16-15(20)14(19)13(18)12(9-17)23-16/h2-7,12-20H,8-9H2,1H3/b3-2-/t12-,13-,14+,15-,16-/m1/s1
InChIKey XRQSXJGKRJVWSU-JNDSXIQISA-N
Molecular Weight 326.345 g/mol
SMILES O[C@]1([C@@]([C@]([C@@](O[C@@]1(CO)[H])(OC\C=C/c1ccc(cc1)OC)[H])(O)[H])(O)[H])[H]
SPLASH splash10-0002-1900000000-59fa4637591a3e691f14
Source of Spectrum JX-2015-6-9377
Wiley ID 1730269