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trimethylsilyl (E)-3-(5-(1(13)C)methoxy-4-trimethylsilyloxy-(1,2,3,4,5,6-(13)C6)cyclohexa-1,3,5-trien-1-yl)(1,2,3-(13)C3)prop-2-enoate
SpectraBase Compound ID LrEjBN9Uuto
InChI InChI=1S/C16H26O4Si2/c1-18-15-12-13(8-10-14(15)19-21(2,3)4)9-11-16(17)20-22(5,6)7/h8-12H,1-7H3/b11-9+/i1+1,8+1,9+1,10+1,11+1,12+1,13+1,14+1,15+1,16+1
InChIKey UQBSUVIBJIXFQT-OMMQTFPUSA-N
Mol Weight 348.47 g/mol
Molecular Formula C613C10H26O4Si2
Exact Mass 348.170511 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HvXw9kYgN9j
Name trimethylsilyl (E)-3-(5-(1(13)C)methoxy-4-trimethylsilyloxy-(1,2,3,4,5,6-(13)C6)cyclohexa-1,3,5-trien-1-yl)(1,2,3-(13)C3)prop-2-enoate
Carrier Gas Helium
Comments Original formula: C6[13C]10H26O4Si2
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Formula C16H26O4Si2
GC Oven Program Oven temp 300oC, Splitless injector
InChI InChI=1S/C16H26O4Si2/c1-18-15-12-13(8-10-14(15)19-21(2,3)4)9-11-16(17)20-22(5,6)7/h8-12H,1-7H3/b11-9+/i1+1,8+1,9+1,10+1,11+1,12+1,13+1,14+1,15+1,16+1
InChIKey UQBSUVIBJIXFQT-OMMQTFPUSA-N
Instrument Name Agilent 7890B/7200 GC/QTOF-MS
Ionization Type EI
Literature Reference DOI 10.1002/rcm.9287
Molecular Weight 348.474 g/mol
SMILES [13cH]1[13cH][13c]([13cH][13c](O[13CH3])[13c]1O[Si](C)(C)C)\[13CH]=[13CH]\[13C](O[Si](C)(C)C)=O
SPLASH splash10-000t-1239000000-547f449c86b0c3588a15
Source of Spectrum RCM-36-3-Figure 1 D
Wiley ID 1876972