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5S-BROMO-6S-PROSTAGLANDIN-PGI1 METHYL ESTER
SpectraBase Compound ID 1gXdMx1gytY
InChI InChI=1S/C21H35BrO5/c1-3-4-5-7-14(23)10-11-15-16-12-20(27-19(16)13-18(15)24)17(22)8-6-9-21(25)26-2/h10-11,14-20,23-24H,3-9,12-13H2,1-2H3/b11-10+/t14-,15+,16+,17-,18+,19-,20-/m1/s1
InChIKey XMWBVFLPGPGUEH-MAINIWLZSA-N
Mol Weight 447.4 g/mol
Molecular Formula C21H35BrO5
Exact Mass 446.166787 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GH2UOJhjhV2
Name 5S-BROMO-6S-PROSTAGLANDIN-PGI1 METHYL ESTER
Comments 40
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H35BrO5
InChI InChI=1S/C21H35BrO5/c1-3-4-5-7-14(23)10-11-15-16-12-20(27-19(16)13-18(15)24)17(22)8-6-9-21(25)26-2/h10-11,14-20,23-24H,3-9,12-13H2,1-2H3/b11-10+/t14-,15+,16+,17-,18+,19-,20-/m1/s1
InChIKey XMWBVFLPGPGUEH-MAINIWLZSA-N
Instrument Name Bruker WH-90
Literature Reference T.VALIMAE, T.PEHK, E.LIPPMAA, M.LOPP, U.LILLE (1986) Izv.Akad.Nauk Estonii,Khim.(Russ. Lang.): v.35, N3, 165-192.
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported