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1-(2,3,5-Tri-O-acetyl-.beta.-D-ribofuranosyl)-2,4-bis(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine
SpectraBase Compound ID E50MNbHiD5L
InChI InChI=1S/C19H17F6N3O7/c1-7(29)32-6-11-12(33-8(2)30)13(34-9(3)31)16(35-11)28-5-4-10-14(18(20,21)22)26-17(19(23,24)25)27-15(10)28/h4-5,11-13,16H,6H2,1-3H3/t11-,12-,13-,16-/m1/s1
InChIKey BOGFBVRNVBFZSX-BRXULGCHSA-N
Mol Weight 513.35 g/mol
Molecular Formula C19H17F6N3O7
Exact Mass 513.097069 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HmcXjJWestm
Name 1-(2,3,5-Tri-O-acetyl-.beta.-D-ribofuranosyl)-2,4-bis(trifluoromethyl)-7H-pyrrolo[2,3-d]pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17F6N3O7
InChI InChI=1S/C19H17F6N3O7/c1-7(29)32-6-11-12(33-8(2)30)13(34-9(3)31)16(35-11)28-5-4-10-14(18(20,21)22)26-17(19(23,24)25)27-15(10)28/h4-5,11-13,16H,6H2,1-3H3/t11-,12-,13-,16-/m1/s1
InChIKey BOGFBVRNVBFZSX-BRXULGCHSA-N
Molecular Weight 513.349 g/mol
SMILES c12[n](ccc2c(C(F)(F)F)nc(n1)C(F)(F)F)[C@]1([C@@]([C@](OC(=O)C)([C@](O1)(COC(=O)C)[H])[H])(OC(=O)C)[H])[H]
SPLASH splash10-0zi0-0294430000-e0aeaaf12642b83e27ec
Source of Spectrum F4-41-1856-21b
Wiley ID 1672476