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6,7,14,15-Tetradehydro-8,11-thio-LTB4 - Methyl Ester
SpectraBase Compound ID DT3xaWMRNaD
InChI InChI=1S/C21H28O4S/c1-3-4-5-6-7-8-11-19(23)20-16-15-18(26-20)14-13-17(22)10-9-12-21(24)25-2/h15-17,19,22-23H,3-6,9-12H2,1-2H3
InChIKey RSYSNEOCOPVOIK-UHFFFAOYSA-N
Mol Weight 376.51 g/mol
Molecular Formula C21H28O4S
Exact Mass 376.170831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6n0naFtOz4E
Name 6,7,14,15-Tetradehydro-8,11-thio-LTB4 - Methyl Ester
Alternate Name(s) 6,7,14,15-Tetradehydro-8,11-thio-[leucotriene-b4]- methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O4S
InChI InChI=1S/C21H28O4S/c1-3-4-5-6-7-8-11-19(23)20-16-15-18(26-20)14-13-17(22)10-9-12-21(24)25-2/h15-17,19,22-23H,3-6,9-12H2,1-2H3
InChIKey RSYSNEOCOPVOIK-UHFFFAOYSA-N
Molecular Weight 376.511 g/mol
SMILES OC(C#Cc1sc(C(CC#CCCCCC)O)cc1)CCCC(=O)OC
SPLASH splash10-000i-4090000000-5283e2033a6d2a6d81b9
Source of Spectrum D9-4-111-10
Wiley ID 1546181