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1,2-o-Isopropylideneglycerol, 3-(o-2-methylaminoethyl)-(o-2-carboethoxy-2-tritylaminoethyl)phosphate

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1,2-o-Isopropylideneglycerol, 3-(o-2-methylaminoethyl)-(o-2-carboethoxy-2-tritylaminoethyl)phosphate
SpectraBase Compound ID 3Ywz2jRrLcq
InChI InChI=1S/C33H43N2O8P/c1-5-38-31(36)30(25-42-44(37,40-22-21-34-4)41-24-29-23-39-32(2,3)43-29)35-33(26-15-9-6-10-16-26,27-17-11-7-12-18-27)28-19-13-8-14-20-28/h6-20,29-30,34-35H,5,21-25H2,1-4H3
InChIKey KEECLEYFRGHUAZ-UHFFFAOYSA-N
Mol Weight 626.7 g/mol
Molecular Formula C33H43N2O8P
Exact Mass 626.275703 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID sAWNAZ1wAN
Name 1,2-o-Isopropylideneglycerol, 3-(o-2-methylaminoethyl)-(o-2-carboethoxy-2-tritylaminoethyl)phosphate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 626.275703343 u
Formula C33H43N2O8P
InChI InChI=1S/C33H43N2O8P/c1-5-38-31(36)30(25-42-44(37,40-22-21-34-4)41-24-29-23-39-32(2,3)43-29)35-33(26-15-9-6-10-16-26,27-17-11-7-12-18-27)28-19-13-8-14-20-28/h6-20,29-30,34-35H,5,21-25H2,1-4H3
InChIKey KEECLEYFRGHUAZ-UHFFFAOYSA-N
Molecular Weight 626.687 g/mol
SMILES N(CCOP(OCC(C(=O)OCC)NC(c1ccccc1)(c1ccccc1)c1ccccc1)(OCC1COC(O1)(C)C)=O)C