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(3R*,4S*,5R*)-3-Ethyl-3-[3,4-(methylenedioxy)benzyl]-4-[[(methoxymethyl)oxy]methyl]-5-(3,4-dimethoxyphenyl]-.gamma.-butyrolactone

View entire compound with spectra: 1 MS (GC)

(3R*,4S*,5R*)-3-Ethyl-3-[3,4-(methylenedioxy)benzyl]-4-[[(methoxymethyl)oxy]methyl]-5-(3,4-dimethoxyphenyl]-.gamma.-butyrolactone
SpectraBase Compound ID 5bH6w4szPq2
InChI InChI=1S/C25H30O8/c1-5-25(12-16-6-8-19-21(10-16)32-15-31-19)22(13-30-14-27-2)33-24(26)23(25)17-7-9-18(28-3)20(11-17)29-4/h6-11,22-23H,5,12-15H2,1-4H3
InChIKey BKMSZSUJOBMDKU-UHFFFAOYSA-N
Mol Weight 458.51 g/mol
Molecular Formula C25H30O8
Exact Mass 458.194068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H7JApsm2sxD
Name (3R*,4S*,5R*)-3-Ethyl-3-[3,4-(methylenedioxy)benzyl]-4-[[(methoxymethyl)oxy]methyl]-5-(3,4-dimethoxyphenyl]-.gamma.-butyrolactone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30O8
InChI InChI=1S/C25H30O8/c1-5-25(12-16-6-8-19-21(10-16)32-15-31-19)22(13-30-14-27-2)33-24(26)23(25)17-7-9-18(28-3)20(11-17)29-4/h6-11,22-23H,5,12-15H2,1-4H3
InChIKey BKMSZSUJOBMDKU-UHFFFAOYSA-N
Molecular Weight 458.507 g/mol
SMILES C1(C(C(=O)OC1COCOC)c1cc(OC)c(cc1)OC)(Cc1cc2OCOc2cc1)CC
SPLASH splash10-000i-0900200000-7017556c48f08c21f086
Source of Spectrum J-61-6929-4
Synonyms 4-(2H-1,3-benzodioxol-5-ylmethyl)-3-(3,4-dimethoxyphenyl)-4-ethyl-5-[(methoxymethoxy)methyl]oxolan-2-one
Wiley ID 1389869