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(1R,7aS)-2-((4R)-4-hydroxy-4-phenyl-3-(trimethylsilyl)buta-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-((4R)-4-hydroxy-4-phenyl-3-(trimethylsilyl)buta-1,2-dienyl)-1-(triethylsilyloxy)tetrahydro-1H-pyrrolo[1,2-c]imidazol-3(2H)-one
SpectraBase Compound ID IHhb5SC4TM6
InChI InChI=1S/C25H40N2O3Si2/c1-7-32(8-2,9-3)30-24-21-16-13-18-26(21)25(29)27(24)19-17-22(31(4,5)6)23(28)20-14-11-10-12-15-20/h10-12,14-15,19,21,23-24,28H,7-9,13,16,18H2,1-6H3/t17?,21-,23+,24+/m0/s1
InChIKey OHDUWSFIDJIDMB-XMSGWFLFSA-N
Mol Weight 472.8 g/mol
Molecular Formula C25H40N2O3Si2
Exact Mass 472.257746 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID APvDG27tmle
Name (1R,7aS)-2-((4R)-4-hydroxy-4-phenyl-3-(trimethylsilyl)buta-1,2-dienyl)-1-(triethylsilyloxy)tetrahydro-1H-pyrrolo[1,2-c]imidazol-3(2H)-one
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H40N2O3Si2
InChI InChI=1S/C25H40N2O3Si2/c1-7-32(8-2,9-3)30-24-21-16-13-18-26(21)25(29)27(24)19-17-22(31(4,5)6)23(28)20-14-11-10-12-15-20/h10-12,14-15,19,21,23-24,28H,7-9,13,16,18H2,1-6H3/t17?,21-,23+,24+/m0/s1
InChIKey OHDUWSFIDJIDMB-XMSGWFLFSA-N
Instrument Name Micromass GCT
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202000574
Molecular Weight 472.776 g/mol
Optical Rotation [a]D = -183 (c = 1.02, acetone)
Reported Formula C25H40N2O3Si2
SMILES O[C@@](C(=C=CN1[C@@]([C@]2(N(C1=O)CCC2)[H])(O[Si](CC)(CC)CC)[H])[Si](C)(C)C)(c1ccccc1)[H]
SPLASH splash10-014i-0629000000-68c1954e8d9877d8577d
Sample Comments dr > 95:5
Source of Spectrum ASC-362-4406-19d
Thin-Layer Chromatography Rf = 0.44 (silica gel, EtOAc/hexanes, 30:70)
Wiley ID 1855567