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Helicin, tetra-TMS
SpectraBase Compound ID 4cloiS7pcju
InChI InChI=1S/C25H48O7Si4/c1-33(2,3)27-18-21-22(30-34(4,5)6)23(31-35(7,8)9)24(32-36(10,11)12)25(29-21)28-20-16-14-13-15-19(20)17-26/h13-17,21-25H,18H2,1-12H3
InChIKey NXBHNIJWYVKVQF-UHFFFAOYSA-N
Mol Weight 573.0 g/mol
Molecular Formula C25H48O7Si4
Exact Mass 572.24771 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8jdq0REkiTD
Name Helicin, tetra-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 572.247710019 u
Formula C25H48O7Si4
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C25H48O7Si4/c1-33(2,3)27-18-21-22(30-34(4,5)6)23(31-35(7,8)9)24(32-36(10,11)12)25(29-21)28-20-16-14-13-15-19(20)17-26/h13-17,21-25H,18H2,1-12H3
InChIKey NXBHNIJWYVKVQF-UHFFFAOYSA-N
Molecular Weight 572.992 g/mol
Nominal Mass 572 u
Number of Peaks 195
SMILES c1cc(c(cc1)OC1C(C(O[Si](C)(C)C)C(C(O1)CO[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)C=O
SPLASH splash10-03k9-5968000000-80fa4075de77be43b652
Source Sigma-Aldrich; Salix sp. bark
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Synonyms Salcylaldehyde .beta.-D-glucoside, tetra-TMS
Wiley ID VI001284