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TOCOPHEROLMANNOSIDE
SpectraBase Compound ID IIxZ45txZec
InChI InChI=1S/C39H66B2O7/c1-11-40-42-24-32(46-40)35-36-37(48-41(12-2)47-36)38(44-35)43-33-28(7)29(8)34-31(30(33)9)21-23-39(10,45-34)22-15-20-27(6)19-14-18-26(5)17-13-16-25(3)4/h25-27,32,35-38H,11-24H2,1-10H3
InChIKey UVVGWJQYXHGVPJ-UHFFFAOYSA-N
Mol Weight 668.6 g/mol
Molecular Formula C39H66B2O7
Exact Mass 668.499465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K0OAK72BKKm
Name TOCOPHEROLMANNOSIDE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C39H66B2O7
InChI InChI=1S/C39H66B2O7/c1-11-40-42-24-32(46-40)35-36-37(48-41(12-2)47-36)38(44-35)43-33-28(7)29(8)34-31(30(33)9)21-23-39(10,45-34)22-15-20-27(6)19-14-18-26(5)17-13-16-25(3)4/h25-27,32,35-38H,11-24H2,1-10H3
InChIKey UVVGWJQYXHGVPJ-UHFFFAOYSA-N
Instrument Name 311A
Molecular Weight 668.4977
SMILES C1(Oc2c(C)c3CCC(CCCC(CCCC(CCCC(C)C)C)C)(Oc3c(C)c2C)C)C2OB(CC)OC2C(C2COB(CC)O2)O1
SPLASH splash10-003r-9410801000-293dfc1755ad80674dc0
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany