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(1S,1'S,2S,3R)-2-{1'-Hydroxy-2'-[4"-(methoxyphenyl)methyl]oxy}ethyl-3-(methoxymethyl)oxy-1-phenylsulfonyl-1-ethylcyclopentane
SpectraBase Compound ID 8D45WArH3M1
InChI InChI=1S/C25H34O7S/c1-4-25(33(27,28)21-8-6-5-7-9-21)15-14-23(32-18-29-2)24(25)22(26)17-31-16-19-10-12-20(30-3)13-11-19/h5-13,22-24,26H,4,14-18H2,1-3H3/t22-,23-,24+,25+/m1/s1
InChIKey YUZLJRCGESLRBM-NGSHPTGOSA-N
Mol Weight 478.6 g/mol
Molecular Formula C25H34O7S
Exact Mass 478.202525 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zZLTtMlhLh
Name (1S,1'S,2S,3R)-2-{1'-Hydroxy-2'-[4"-(methoxyphenyl)methyl]oxy}ethyl-3-(methoxymethyl)oxy-1-phenylsulfonyl-1-ethylcyclopentane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34O7S
InChI InChI=1S/C25H34O7S/c1-4-25(33(27,28)21-8-6-5-7-9-21)15-14-23(32-18-29-2)24(25)22(26)17-31-16-19-10-12-20(30-3)13-11-19/h5-13,22-24,26H,4,14-18H2,1-3H3/t22-,23-,24+,25+/m1/s1
InChIKey YUZLJRCGESLRBM-NGSHPTGOSA-N
Molecular Weight 478.600 g/mol
SMILES O[C@@]([C@@]1([C@@](S(=O)(=O)c2ccccc2)(CC[C@]1(OCOC)[H])CC)[H])(COCc1ccc(cc1)OC)[H]
SPLASH splash10-00di-0900000000-91bced2c166eeb135043
Source of Spectrum F-56-8090-0
Wiley ID 858931