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4-[2',3',5'-tris( O-Benzyl)-.beta.-D-ribofuranosyl-3,6-bis(trifluoromethyl)-pyridazine
SpectraBase Compound ID DJzKZOvVk0t
InChI InChI=1S/C32H28F6N2O4/c33-31(34,35)26-16-24(30(40-39-26)32(36,37)38)27-29(43-19-23-14-8-3-9-15-23)28(42-18-22-12-6-2-7-13-22)25(44-27)20-41-17-21-10-4-1-5-11-21/h1-16,25,27-29H,17-20H2/t25-,27+,28-,29+/m1/s1
InChIKey YXWIQSFLWBIXHO-MXYFDVTLSA-N
Mol Weight 618.6 g/mol
Molecular Formula C32H28F6N2O4
Exact Mass 618.195326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AIRasUyFpq1
Name 4-[2',3',5'-tris( O-Benzyl)-.beta.-D-ribofuranosyl-3,6-bis(trifluoromethyl)-pyridazine
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H28F6N2O4
InChI InChI=1S/C32H28F6N2O4/c33-31(34,35)26-16-24(30(40-39-26)32(36,37)38)27-29(43-19-23-14-8-3-9-15-23)28(42-18-22-12-6-2-7-13-22)25(44-27)20-41-17-21-10-4-1-5-11-21/h1-16,25,27-29H,17-20H2/t25-,27+,28-,29+/m1/s1
InChIKey YXWIQSFLWBIXHO-MXYFDVTLSA-N
Molecular Weight 618.576 g/mol
SMILES c1(c(nnc(c1)C(F)(F)F)C(F)(F)F)[C@]1([C@@]([C@](OCc2ccccc2)([C@](O1)(COCc1ccccc1)[H])[H])(OCc1ccccc1)[H])[H]
SPLASH splash10-016r-0000069000-42a35dbd334c042e60b7
Source of Spectrum D8-327-367-4
Wiley ID 1515314