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Isomaltose methoxime, octa-TMS, isomer 1
SpectraBase Compound ID JWMF2eRm9FL
InChI InChI=1S/C37H89NO11Si8/c1-39-38-26-29(43-51(5,6)7)32(45-53(11,12)13)34(47-55(17,18)19)31(44-52(8,9)10)27-40-37-36(49-57(23,24)25)35(48-56(20,21)22)33(46-54(14,15)16)30(42-37)28-41-50(2,3)4/h26,29-37H,27-28H2,1-25H3/b38-26+
InChIKey IBUWRFQPAQWUEY-DZTJYMNTSA-N
Mol Weight 948.8 g/mol
Molecular Formula C37H89NO11Si8
Exact Mass 947.458975 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2ScCscBWTo
Name Isomaltose methoxime, octa-TMS, isomer 1
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 947.458974959 u
Formula C37H89NO11Si8
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C37H89NO11Si8/c1-39-38-26-29(43-51(5,6)7)32(45-53(11,12)13)34(47-55(17,18)19)31(44-52(8,9)10)27-40-37-36(49-57(23,24)25)35(48-56(20,21)22)33(46-54(14,15)16)30(42-37)28-41-50(2,3)4/h26,29-37H,27-28H2,1-25H3/b38-26+
InChIKey IBUWRFQPAQWUEY-DZTJYMNTSA-N
Molecular Weight 948.795 g/mol
Nominal Mass 947 u
Number of Peaks 398
SMILES C[Si](OC(C(O[Si](C)(C)C)COC1OC(C(C(C1O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)CO[Si](C)(C)C)C(C(\C=N\OC)O[Si](C)(C)C)O[Si](C)(C)C)(C)C
SPLASH splash10-03di-3698000000-2e866e6fd05172e9ca99
Source isomaltose methoximation
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI001455