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D-Mannitol, 1,3:4,6-bis-O-(phenylmethylene)-2,5-bis-O-(3,7,11,15-tetramethylhexad ecyl)-, [1(R),4(R)]-
SpectraBase Compound ID 8GEdxdKU2DU
InChI InChI=1S/C60H102O6/c1-45(2)23-17-25-47(5)27-19-29-49(7)31-21-33-51(9)39-41-61-55-43-63-59(53-35-13-11-14-36-53)65-57(55)58-56(44-64-60(66-58)54-37-15-12-16-38-54)62-42-40-52(10)34-22-32-50(8)30-20-28-48(6)26-18-24-46(3)4/h11-16,35-38,45-52,55-60H,17-34,39-44H2,1-10H3
InChIKey AEFQBMSLPQYANA-UHFFFAOYSA-N
Mol Weight 919.5 g/mol
Molecular Formula C60H102O6
Exact Mass 918.767641 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HKP8X3krAid
Name D-Mannitol, 1,3:4,6-bis-O-(phenylmethylene)-2,5-bis-O-(3,7,11,15-tetramethylhexad ecyl)-, [1(R),4(R)]-
CAS Registry Number 82521-18-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C60H102O6
InChI InChI=1S/C60H102O6/c1-45(2)23-17-25-47(5)27-19-29-49(7)31-21-33-51(9)39-41-61-55-43-63-59(53-35-13-11-14-36-53)65-57(55)58-56(44-64-60(66-58)54-37-15-12-16-38-54)62-42-40-52(10)34-22-32-50(8)30-20-28-48(6)26-18-24-46(3)4/h11-16,35-38,45-52,55-60H,17-34,39-44H2,1-10H3
InChIKey AEFQBMSLPQYANA-UHFFFAOYSA-N
Molecular Weight 919.470 g/mol
SMILES C1(C2OC(c3ccccc3)OCC2OCCC(CCCC(CCCC(CCCC(C)C)C)C)C)OC(c2ccccc2)OCC1OCCC(CCCC(CCCC(CCCC(C)C)C)C)C
SPLASH splash10-006t-9700000002-b7654a1bce61a578092c
Source of Spectrum F-39-2214-0
Synonyms 1,3(R): 4,6(R)-di-O-benzyliden-2,5-di-O-(2,3-dihydrophytyl)-D-mannitol 2-Phenyl-4-{2-phenyl-5-[(3,7,11,15-tetramethylhexadecyl)oxy]-1,3-dioxan-4-yl}-5-[(3,7,11,15-tetramethylhexadecyl)oxy]-1,3-dioxane
Wiley ID 1418131