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20,56-Bis(benzyloxymethyl)-3,7,11,15,24,28,32,36,39,43,47,51,60,64,68,72-hexadecamethyl-18,21,54,57-tetraoxatetraheptacont-1,37,73-triene
SpectraBase Compound ID 5g1FI7cKFjF
InChI InChI=1S/C102H184O6/c1-19-83(3)39-27-41-85(5)43-29-47-89(9)53-35-59-95(15)69-73-103-79-102(82-106-78-100-65-25-22-26-66-100)108-76-72-98(18)62-38-56-92(12)50-32-46-88(8)52-34-58-94(14)68-67-93(13)57-33-51-87(7)45-31-49-90(10)54-36-60-96(16)70-74-104-80-101(81-105-77-99-63-23-21-24-64-99)107-75-71-97(17)61-37-55-91(11)48-30-44-86(6)42-28-40-84(4)20-2/h19-26,63-68,83-98,101-102H,1-2,27-62,69-82H2,3-18H3/t83-,84-,85-,86-,87+,88+,89-,90-,91-,92-,93?,94+,95-,96-,97-,98-,101?,102?/m1/s1
InChIKey MSMJAMJZNXUZKB-WAJWDEBRSA-N
Mol Weight 1506.6 g/mol
Molecular Formula C102H184O6
Exact Mass 1505.409294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AKLqwLKXPnf
Name 20,56-Bis(benzyloxymethyl)-3,7,11,15,24,28,32,36,39,43,47,51,60,64,68,72-hexadecamethyl-18,21,54,57-tetraoxatetraheptacont-1,37,73-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C102H184O6
InChI InChI=1S/C102H184O6/c1-19-83(3)39-27-41-85(5)43-29-47-89(9)53-35-59-95(15)69-73-103-79-102(82-106-78-100-65-25-22-26-66-100)108-76-72-98(18)62-38-56-92(12)50-32-46-88(8)52-34-58-94(14)68-67-93(13)57-33-51-87(7)45-31-49-90(10)54-36-60-96(16)70-74-104-80-101(81-105-77-99-63-23-21-24-64-99)107-75-71-97(17)61-37-55-91(11)48-30-44-86(6)42-28-40-84(4)20-2/h19-26,63-68,83-98,101-102H,1-2,27-62,69-82H2,3-18H3/t83-,84-,85-,86-,87+,88+,89-,90-,91-,92-,93?,94+,95-,96-,97-,98-,101?,102?/m1/s1
InChIKey MSMJAMJZNXUZKB-WAJWDEBRSA-N
Molecular Weight 1506.588 g/mol
SMILES C(=C[C@](CCC[C@](CCC[C@](CCC[C@](CCOC(COCc1ccccc1)COCC[C@@](CCC[C@@](CCC[C@@](CCC[C@@](C=C)(C)[H])(C)[H])(C)[H])(C)[H])(C)[H])(C)[H])(C)[H])(C)[H])C(CCC[C@](CCC[C@](CCC[C@](CCOCC(OCC[C@@](CCC[C@@](CCC[C@@](CCC[C@@](C=C)(C)[H])(C)[H])(C)[H])(C)[H])COCc1ccccc1)(C)[H])(C)[H])(C)[H])C
SPLASH splash10-08fr-0004900000-de7af1c227b175c9dd06
Source of Spectrum J-63-4745-7
Wiley ID 1418837