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Phlorizin, hepta-TMS
SpectraBase Compound ID FNWHIh9wDmg
InChI InChI=1S/C42H80O10Si7/c1-53(2,3)44-30-37-39(50-57(13,14)15)40(51-58(16,17)18)41(52-59(19,20)21)42(46-37)45-35-28-33(48-55(7,8)9)29-36(49-56(10,11)12)38(35)34(43)27-24-31-22-25-32(26-23-31)47-54(4,5)6/h22-23,25-26,28-29,37,39-42H,24,27,30H2,1-21H3
InChIKey DQEBGUMUFFIYTQ-UHFFFAOYSA-N
Mol Weight 941.7 g/mol
Molecular Formula C42H80O10Si7
Exact Mass 940.413635 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7TSxIPjkB2Y
Name Phlorizin, hepta-TMS
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 940.413634511 u
Formula C42H80O10Si7
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C42H80O10Si7/c1-53(2,3)44-30-37-39(50-57(13,14)15)40(51-58(16,17)18)41(52-59(19,20)21)42(46-37)45-35-28-33(48-55(7,8)9)29-36(49-56(10,11)12)38(35)34(43)27-24-31-22-25-32(26-23-31)47-54(4,5)6/h22-23,25-26,28-29,37,39-42H,24,27,30H2,1-21H3
InChIKey DQEBGUMUFFIYTQ-UHFFFAOYSA-N
Molecular Weight 941.687 g/mol
Nominal Mass 940 u
Number of Peaks 513
SMILES c1(CCC(c2c(cc(cc2OC2OC(C(C(C2O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)CO[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)=O)ccc(cc1)O[Si](C)(C)C
SPLASH splash10-01vo-3659110000-ca9d37c00a244c27a1ac
Source Sigma
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI000372