For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3,4,5-Tri-O-acetyl-1,6-di-O-tritylhex-2-ulose
SpectraBase Compound ID 5LOMJZCjmcH
InChI InChI=1S/C50H46O9/c1-36(51)57-46(35-56-50(42-28-16-7-17-29-42,43-30-18-8-19-31-43)44-32-20-9-21-33-44)48(59-38(3)53)47(58-37(2)52)45(54)34-55-49(39-22-10-4-11-23-39,40-24-12-5-13-25-40)41-26-14-6-15-27-41/h4-33,46-48H,34-35H2,1-3H3
InChIKey YBBUVOCAERJJDL-UHFFFAOYSA-N
Mol Weight 790.9 g/mol
Molecular Formula C50H46O9
Exact Mass 790.314183 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Cuk6pwCNBmw
Name 3,4,5-Tri-O-acetyl-1,6-di-O-tritylhex-2-ulose
Alternate Name(s) 1,6-Ditritylfrutcose triacetate Acetic acid [3,4-diacetyloxy-5-oxo-1,6-bis-(triphenylmethyl)oxyhexan-2-yl] ester (3,4-diacetyloxy-5-oxo-1,6-ditrityloxyhexan-2-yl) acetate [2,3-diacetoxy-4-oxo-5-trityloxy-1-(trityloxymethyl)pentyl] acetate [3,4-diacetyloxy-5-oxidanylidene-1,6-bis-(triphenylmethyl)oxy-hexan-2-yl] ethanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C50H46O9
InChI InChI=1S/C50H46O9/c1-36(51)57-46(35-56-50(42-28-16-7-17-29-42,43-30-18-8-19-31-43)44-32-20-9-21-33-44)48(59-38(3)53)47(58-37(2)52)45(54)34-55-49(39-22-10-4-11-23-39,40-24-12-5-13-25-40)41-26-14-6-15-27-41/h4-33,46-48H,34-35H2,1-3H3
InChIKey YBBUVOCAERJJDL-UHFFFAOYSA-N
Molecular Weight 790.909 g/mol
SMILES C(OC(c1ccccc1)(c1ccccc1)c1ccccc1)C(C(C(C(OC(=O)C)COC(c1ccccc1)(c1ccccc1)c1ccccc1)OC(C)=O)OC(C)=O)=O
SPLASH splash10-0006-1390000000-281044f21eafbf85af95
Source of Spectrum NP-16-2855-0
Wiley ID 1113381