For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(S)-2-(4,5,7-triacetoxy-2,2-dimethyl-3-(3-oxobutyl)-2,3-dihydrobenzofuran-6-yl)acetic acid
SpectraBase Compound ID K7zmhQYaz50
InChI InChI=1S/C22H26O10/c1-10(23)7-8-15-17-20(31-13(4)26)18(29-11(2)24)14(9-16(27)28)19(30-12(3)25)21(17)32-22(15,5)6/h15H,7-9H2,1-6H3,(H,27,28)/t15-/m0/s1
InChIKey GSFXFUHJMNBLHO-HNNXBMFYSA-N
Mol Weight 450.44 g/mol
Molecular Formula C22H26O10
Exact Mass 450.152597 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EhpAKXc7fpP
Name (S)-2-(4,5,7-triacetoxy-2,2-dimethyl-3-(3-oxobutyl)-2,3-dihydrobenzofuran-6-yl)acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O10
InChI InChI=1S/C22H26O10/c1-10(23)7-8-15-17-20(31-13(4)26)18(29-11(2)24)14(9-16(27)28)19(30-12(3)25)21(17)32-22(15,5)6/h15H,7-9H2,1-6H3,(H,27,28)/t15-/m0/s1
InChIKey GSFXFUHJMNBLHO-HNNXBMFYSA-N
Molecular Weight 450.440 g/mol
SMILES OC(Cc1c(c(c2c(c1OC(C)=O)OC([C@]2(CCC(C)=O)[H])(C)C)OC(C)=O)OC(C)=O)=O
SPLASH splash10-0aba-0059000000-d893205040139480e0d5
Source of Spectrum K-108-3691-5
Wiley ID 1793843