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

*Links on SpectraBase are not permalinks.

2,3: 4,5-bis[O-(1'-Methylethylidene)-1-deoxy-1-[(2",6"-dichloropyrimidin-4"-yl)-(3"'-methoxy-4'"-methylphenyl)amino]-D-ribitol

View entire compound with spectra: 1 MS (GC)

2,3: 4,5-bis[O-(1'-Methylethylidene)-1-deoxy-1-[(2",6"-dichloropyrimidin-4"-yl)-(3"'-methoxy-4'"-methylphenyl)amino]-D-ribitol
SpectraBase Compound ID HtqwZCgP2WI
InChI InChI=1S/C23H29Cl2N3O5/c1-13-7-8-14(9-15(13)29-6)28(19-10-18(24)26-21(25)27-19)11-16-20(33-23(4,5)31-16)17-12-30-22(2,3)32-17/h7-10,16-17,20H,11-12H2,1-6H3/t16-,17+,20-/m0/s1
InChIKey JTUBHMYZBCQRCJ-QKLQHJQFSA-N
Mol Weight 498.41 g/mol
Molecular Formula C23H29Cl2N3O5
Exact Mass 497.148426 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 Ce7zF8gNEr0
Name 2,3: 4,5-bis[O-(1'-Methylethylidene)-1-deoxy-1-[(2",6"-dichloropyrimidin-4"-yl)-(3"'-methoxy-4'"-methylphenyl)amino]-D-ribitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H29Cl2N3O5
InChI InChI=1S/C23H29Cl2N3O5/c1-13-7-8-14(9-15(13)29-6)28(19-10-18(24)26-21(25)27-19)11-16-20(33-23(4,5)31-16)17-12-30-22(2,3)32-17/h7-10,16-17,20H,11-12H2,1-6H3/t16-,17+,20-/m0/s1
InChIKey JTUBHMYZBCQRCJ-QKLQHJQFSA-N
Molecular Weight 498.407 g/mol
SMILES c1(nc(Cl)nc(c1)Cl)N(C[C@]1([C@@]([C@@]2(OC(C)(C)OC2)[H])(OC(O1)(C)C)[H])[H])c1cc(OC)c(cc1)C
SPLASH splash10-001r-0090200000-ccaf1df812c0c6581f6f
Source of Spectrum D8-323-876-8
Wiley ID 1513855