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Cyclopentanepropanoic acid, 5-(methoxyimino)-2-[3-(methoxyimino)octyl]-3-[(trimethylsilyl)oxy]-, [1R-(1.alpha.,2.beta.,3.alpha.)]-
SpectraBase Compound ID HJzS5k44DE7
InChI InChI=1S/C21H40N2O5Si/c1-7-8-9-10-16(22-26-2)11-12-18-17(13-14-21(24)25)19(23-27-3)15-20(18)28-29(4,5)6/h17-18,20H,7-15H2,1-6H3,(H,24,25)/b22-16+,23-19+/t17-,18-,20-/m1/s1
InChIKey XSVLHBWLAKQNFX-XSDHXLFWSA-N
Mol Weight 428.6 g/mol
Molecular Formula C21H40N2O5Si
Exact Mass 428.270649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9xvYioib3nz
Name Cyclopentanepropanoic acid, 5-(methoxyimino)-2-[3-(methoxyimino)octyl]-3-[(trimethylsilyl)oxy]-, [1R-(1.alpha.,2.beta.,3.alpha.)]-
Alternate Name(s) 3-{(1R,2R,3R,5E)-5-(methoxyimino)-2-[(3E)-3-(methoxyimino)octyl]-3-[(trimethylsilyl)oxy]cyclopentyl}propanoic acid 7.alpha.-hydroxy-5,11-diketotetranorporostanoic acid methoxime TMS ether
CAS Registry Number 55401-47-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H40N2O5Si
InChI InChI=1S/C21H40N2O5Si/c1-7-8-9-10-16(22-26-2)11-12-18-17(13-14-21(24)25)19(23-27-3)15-20(18)28-29(4,5)6/h17-18,20H,7-15H2,1-6H3,(H,24,25)/b22-16+,23-19+/t17-,18-,20-/m1/s1
InChIKey XSVLHBWLAKQNFX-XSDHXLFWSA-N
Molecular Weight 428.645 g/mol
SMILES OC(CC[C@@]1([C@]([C@@](C\C1=N\OC)(O[Si](C)(C)C)[H])(CC\C(=N\OC)CCCCC)[H])[H])=O
SPLASH splash10-00di-0129300000-91a2fc057941ce1620ad
Source of Spectrum C-91-2178-2
Wiley ID 1380616