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Furan, 2-(3,4-dimethoxyphenyl)tetrahydro-4-[(methoxymethoxy)phenylmethyl]-3-(phenylsulfonyl)-, [2S-[2.alpha.,3.beta.,4.alpha.(R*)]]-
SpectraBase Compound ID 65QcxBLTbZN
InChI InChI=1S/C27H30O7S/c1-30-18-34-25(19-10-6-4-7-11-19)22-17-33-26(20-14-15-23(31-2)24(16-20)32-3)27(22)35(28,29)21-12-8-5-9-13-21/h4-16,22,25-27H,17-18H2,1-3H3/t22-,25?,26+,27+/m1/s1
InChIKey FZSHOQIZCSAZQU-QSFBMHPYSA-N
Mol Weight 498.59 g/mol
Molecular Formula C27H30O7S
Exact Mass 498.171224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ANqOtBG6Mce
Name Furan, 2-(3,4-dimethoxyphenyl)tetrahydro-4-[(methoxymethoxy)phenylmethyl]-3-(phenylsulfonyl)-, [2S-[2.alpha.,3.beta.,4.alpha.(R*)]]-
Alternate Name(s) (2S,3S,4R)-2-(3,4-dimethoxyphenyl)-4-[(methoxymethoxy)(phenyl)methyl]-3-(phenylsulfonyl)tetrahydrofuran (2S,3S,4R)-2-(3,4-dimethoxyphenyl)-4-[(methoxymethoxy)(phenyl)methyl]tetrahydro-3-furanyl phenyl sulfone (2S,3S,4R,.alpha.S)-2-(3,4-Dimethoxyphenyl)-3-phenylsulphonyl-4-(.alpha.-methyoxymethyloxybenzyl)tetrahydrofuran
CAS Registry Number 131575-96-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H30O7S
InChI InChI=1S/C27H30O7S/c1-30-18-34-25(19-10-6-4-7-11-19)22-17-33-26(20-14-15-23(31-2)24(16-20)32-3)27(22)35(28,29)21-12-8-5-9-13-21/h4-16,22,25-27H,17-18H2,1-3H3/t22-,25?,26+,27+/m1/s1
InChIKey FZSHOQIZCSAZQU-QSFBMHPYSA-N
Molecular Weight 498.590 g/mol
SMILES [C@@]1(S(=O)(=O)c2ccccc2)([C@](CO[C@]1(c1cc(OC)c(cc1)OC)[H])(C(c1ccccc1)OCOC)[H])[H]
SPLASH splash10-0a4i-0090000000-a2a8bb6e22d20c2130d5
Source of Spectrum KC-1990-2788-31
Wiley ID 1398547