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13,14-Dihydro-15-deoxy-15,15-(ethylenedioxy)-12-thiaprostaglandin-F(2.alpha.) - Methyl Ester
SpectraBase Compound ID 1IYd0STZrpz
InChI InChI=1S/C22H38O6S/c1-3-4-9-12-22(27-13-14-28-22)16-29-21-17(18(23)15-19(21)24)10-7-5-6-8-11-20(25)26-2/h5,7,17-19,21,23-24H,3-4,6,8-16H2,1-2H3/b7-5-/t17?,18-,19+,21+/m0/s1
InChIKey OBENEBPAIYIZQY-GXHKHPSWSA-N
Mol Weight 430.6 g/mol
Molecular Formula C22H38O6S
Exact Mass 430.23891 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IiJJrlbOUOh
Name 13,14-Dihydro-15-deoxy-15,15-(ethylenedioxy)-12-thiaprostaglandin-F(2.alpha.) - Methyl Ester
Alternate Name(s) 2-[6'-(Methoxycarbonyl)hex-2'-en-1'-yl]-3-[(2''-heptyl)sulfanyl]-cyclopentane-1,4-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H38O6S
InChI InChI=1S/C22H38O6S/c1-3-4-9-12-22(27-13-14-28-22)16-29-21-17(18(23)15-19(21)24)10-7-5-6-8-11-20(25)26-2/h5,7,17-19,21,23-24H,3-4,6,8-16H2,1-2H3/b7-5-/t17?,18-,19+,21+/m0/s1
InChIKey OBENEBPAIYIZQY-GXHKHPSWSA-N
Molecular Weight 430.600 g/mol
SMILES O[C@]1(C[C@]([C@@](C1C\C=C/CCCC(=O)OC)(SCC1(OCCO1)CCCCC)[H])(O)[H])[H]
SPLASH splash10-0006-9500000000-ff9b4e8ae553a556bee9
Source of Spectrum F2-113-122-7
Wiley ID 1549552