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Prosta-9,13-dien-1-oic acid, 11-(hexahydro-1H-azepin-1-yl)-9,15-bis[(trimethylsilyl)oxy]-, trimethylsilyl ester, (13E,15S)-

View entire compound with spectra: 1 MS (GC)

Prosta-9,13-dien-1-oic acid, 11-(hexahydro-1H-azepin-1-yl)-9,15-bis[(trimethylsilyl)oxy]-, trimethylsilyl ester, (13E,15S)-
SpectraBase Compound ID 5HybRlIHUNN
InChI InChI=1S/C35H69NO4Si3/c1-11-12-17-22-30(38-41(2,3)4)25-26-31-32(23-18-13-14-19-24-35(37)40-43(8,9)10)34(39-42(5,6)7)29-33(31)36-27-20-15-16-21-28-36/h25-26,29-33H,11-24,27-28H2,1-10H3/b26-25+/t30-,31+,32+,33?/m0/s1
InChIKey MJJYZAGBIYBEGW-GYLMHNRISA-N
Mol Weight 652.2 g/mol
Molecular Formula C35H69NO4Si3
Exact Mass 651.453439 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HxtSp9SsRi7
Name Prosta-9,13-dien-1-oic acid, 11-(hexahydro-1H-azepin-1-yl)-9,15-bis[(trimethylsilyl)oxy]-, trimethylsilyl ester, (13E,15S)-
Alternate Name(s) 11-Hexamethyleniminal,9-enol pga1 (TMS)3 Trimethylsilyl (13E,15S)-11-hexahydro-1H-azepin-1-yl-9,15-bis[(trimethylsilyl)oxy]prosta-9,13-dien-1-oate
CAS Registry Number 67877-87-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H69NO4Si3
InChI InChI=1S/C35H69NO4Si3/c1-11-12-17-22-30(38-41(2,3)4)25-26-31-32(23-18-13-14-19-24-35(37)40-43(8,9)10)34(39-42(5,6)7)29-33(31)36-27-20-15-16-21-28-36/h25-26,29-33H,11-24,27-28H2,1-10H3/b26-25+/t30-,31+,32+,33?/m0/s1
InChIKey MJJYZAGBIYBEGW-GYLMHNRISA-N
Molecular Weight 652.195 g/mol
SMILES C1(=CC(N2CCCCCC2)[C@@]([C@]1(CCCCCCC(O[Si](C)(C)C)=O)[H])(\C=C\[C@@](O[Si](C)(C)C)(CCCCC)[H])[H])O[Si](C)(C)C
SPLASH splash10-004i-0010901000-a28cb1197024bc702500
Source of Spectrum KO-5-533-1
Wiley ID 1413166