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Apigenin 7-O-glucoside, hexa-TMS
SpectraBase Compound ID DXiitUGOmuR
InChI InChI=1S/C39H68O10Si6/c1-50(2,3)41-26-34-36(47-53(10,11)12)37(48-54(13,14)15)38(49-55(16,17)18)39(44-34)42-29-23-32-35(33(24-29)46-52(7,8)9)30(40)25-31(43-32)27-19-21-28(22-20-27)45-51(4,5)6/h19-25,34,36-39H,26H2,1-18H3
InChIKey JPDXEAGCAHTFEY-UHFFFAOYSA-N
Mol Weight 865.5 g/mol
Molecular Formula C39H68O10Si6
Exact Mass 864.342808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LtGO2yzUIDo
Name Apigenin 7-O-glucoside, hexa-TMS, peak 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 864.342807590 u
Formula C39H68O10Si6
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C39H68O10Si6/c1-50(2,3)41-26-34-36(47-53(10,11)12)37(48-54(13,14)15)38(49-55(16,17)18)39(44-34)42-29-23-32-35(33(24-29)46-52(7,8)9)30(40)25-31(43-32)27-19-21-28(22-20-27)45-51(4,5)6/h19-25,34,36-39H,26H2,1-18H3
InChIKey JPDXEAGCAHTFEY-UHFFFAOYSA-N
Molecular Weight 865.473 g/mol
Nominal Mass 864 u
Number of Peaks 130
SMILES C1(OC(C(C(C1O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)CO[Si](C)(C)C)Oc1cc(c2C(C=C(Oc2c1)c1ccc(cc1)O[Si](C)(C)C)=O)O[Si](C)(C)C
SPLASH splash10-01vk-2239500000-01d827f62107a147a84f
Source Sigma
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Synonyms Apigenin 7-O-glucosioide, hexa-TMS, peak 1
Wiley ID VI001480