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D-Mannitol, 2,5-bis-O-(3,7,11,15-tetramethylhexadecyl)-
SpectraBase Compound ID EuMDfxGAckP
InChI InChI=1S/C46H94O6/c1-35(2)17-11-19-37(5)21-13-23-39(7)25-15-27-41(9)29-31-51-43(33-47)45(49)46(50)44(34-48)52-32-30-42(10)28-16-26-40(8)24-14-22-38(6)20-12-18-36(3)4/h35-50H,11-34H2,1-10H3/t37?,38?,39?,40?,41?,42?,43-,44-,45-,46-/m1/s1
InChIKey HKSDFBFUPDAFQN-VJJUSDEISA-N
Mol Weight 743.3 g/mol
Molecular Formula C46H94O6
Exact Mass 742.705041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LS9nFeA4hAU
Name D-Mannitol, 2,5-bis-O-(3,7,11,15-tetramethylhexadecyl)-
CAS Registry Number 87515-24-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C46H94O6
InChI InChI=1S/C46H94O6/c1-35(2)17-11-19-37(5)21-13-23-39(7)25-15-27-41(9)29-31-51-43(33-47)45(49)46(50)44(34-48)52-32-30-42(10)28-16-26-40(8)24-14-22-38(6)20-12-18-36(3)4/h35-50H,11-34H2,1-10H3/t37?,38?,39?,40?,41?,42?,43-,44-,45-,46-/m1/s1
InChIKey HKSDFBFUPDAFQN-VJJUSDEISA-N
Molecular Weight 743.252 g/mol
SMILES OC[C@]([C@]([C@@]([C@](OCCC(CCCC(CCCC(CCCC(C)C)C)C)C)(CO)[H])(O)[H])(O)[H])(OCCC(CCCC(CCCC(CCCC(C)C)C)C)C)[H]
SPLASH splash10-0a4i-9002000000-615bc6bc0cc6a2d9e58b
Source of Spectrum F-39-2214-0
Synonyms 2,5-bis-O-(3,7,11,15-tetramethylhexadecyl)-D-mannitol 2,5-Di-O-(2,3-dihydrophytyl)-D-mannitol
Wiley ID 1416163