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(4R,5S)-5-(1,3-benzodioxol-5-yl)-4-(veratryloxymethyl)tetrahydrofuran-2-one
SpectraBase Compound ID l5IqAEViC3
InChI InChI=1S/C21H22O7/c1-23-16-5-3-13(7-18(16)24-2)10-25-11-15-9-20(22)28-21(15)14-4-6-17-19(8-14)27-12-26-17/h3-8,15,21H,9-12H2,1-2H3/t15-,21-/m1/s1
InChIKey JVUJTWHEPMDQIZ-QVKFZJNVSA-N
Mol Weight 386.4 g/mol
Molecular Formula C21H22O7
Exact Mass 386.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66bdbnR3ruO
Name (4R,5S)-5-(1,3-benzodioxol-5-yl)-4-(veratryloxymethyl)tetrahydrofuran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O7
InChI InChI=1S/C21H22O7/c1-23-16-5-3-13(7-18(16)24-2)10-25-11-15-9-20(22)28-21(15)14-4-6-17-19(8-14)27-12-26-17/h3-8,15,21H,9-12H2,1-2H3/t15-,21-/m1/s1
InChIKey JVUJTWHEPMDQIZ-QVKFZJNVSA-N
Molecular Weight 386.400 g/mol
SMILES [C@]1(OC(=O)C[C@@]1(COCc1cc(OC)c(cc1)OC)[H])(c1cc2OCOc2cc1)[H]
SPLASH splash10-0ue0-0963000000-f3aee785e33d3c5ad102
Source of Spectrum J-66-6726-34
Synonyms (4R,5S)-5-(1,3-benzodioxol-5-yl)-4-[(3,4-dimethoxyphenyl)methoxymethyl]-2-oxolanone (4R,5S)-5-(1,3-benzodioxol-5-yl)-4-[(3,4-dimethoxyphenyl)methoxymethyl]oxolan-2-one (4R,5S)-5-(1,3-benzodioxol-5-yl)-4-[(3,4-dimethoxyphenyl)methoxymethyl]tetrahydrofuran-2-one
Wiley ID 1535963