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(1R,7aS)-2-(3-(1-hydroxycyclohexyl)-3-(trimethylsilyl)propa-1,2-dienyl)-1-(triethylsilyloxy)tetrahydro-1H-pyrrolo[1,2-c]imidazol-3(2H)-one

View entire compound with spectra: 1 MS (GC)

(1R,7aS)-2-(3-(1-hydroxycyclohexyl)-3-(trimethylsilyl)propa-1,2-dienyl)-1-(triethylsilyloxy)tetrahydro-1H-pyrrolo[1,2-c]imidazol-3(2H)-one
SpectraBase Compound ID BbP0vqaAYsJ
InChI InChI=1S/C24H44N2O3Si2/c1-7-31(8-2,9-3)29-22-20-14-13-18-25(20)23(27)26(22)19-15-21(30(4,5)6)24(28)16-11-10-12-17-24/h19-20,22,28H,7-14,16-18H2,1-6H3/t15?,20-,22+/m0/s1
InChIKey YDSITYOJGHBURV-DIUPPUJESA-N
Mol Weight 464.8 g/mol
Molecular Formula C24H44N2O3Si2
Exact Mass 464.289046 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1McBQs3DM1i
Name (1R,7aS)-2-(3-(1-hydroxycyclohexyl)-3-(trimethylsilyl)propa-1,2-dienyl)-1-(triethylsilyloxy)tetrahydro-1H-pyrrolo[1,2-c]imidazol-3(2H)-one
Appearance Colorless viscous oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H44N2O3Si2
InChI InChI=1S/C24H44N2O3Si2/c1-7-31(8-2,9-3)29-22-20-14-13-18-25(20)23(27)26(22)19-15-21(30(4,5)6)24(28)16-11-10-12-17-24/h19-20,22,28H,7-14,16-18H2,1-6H3/t15?,20-,22+/m0/s1
InChIKey YDSITYOJGHBURV-DIUPPUJESA-N
Instrument Name Micromass GCT
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202000574
Molecular Weight 464.797 g/mol
Optical Rotation [a]D = +9.7 (c = 0.6, acetone)
Reported Formula C24H44N2O3Si2
SMILES OC1(C(=C=CN2[C@@]([C@]3(N(C2=O)CCC3)[H])(O[Si](CC)(CC)CC)[H])[Si](C)(C)C)CCCCC1
SPLASH splash10-0670-1946200000-d70f664a8d2d6e06e856
Sample Comments dr > 95:5
Source of Spectrum ASC-362-4406-19c
Thin-Layer Chromatography Rf = 0.17 (silica gel, Et2O/petroleum Ether, 40:60)
Wiley ID 1855566