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3,6-Dioxabicyclo[3.1.0]hexane, benzamide deriv.
SpectraBase Compound ID IUBaAhzXdIc
InChI InChI=1S/C32H24N4O6/c37-28(21-10-4-1-5-11-21)36(29(38)22-12-6-2-7-13-22)27-24-16-17-35(26(24)33-20-34-27)30-25-32(42-25,18-40-30)19-41-31(39)23-14-8-3-9-15-23/h1-17,20,25,30H,18-19H2
InChIKey PNLWHDRRVUDZCM-UHFFFAOYSA-N
Mol Weight 560.6 g/mol
Molecular Formula C32H24N4O6
Exact Mass 560.169585 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3DU1J78ubQ
Name 3,6-Dioxabicyclo[3.1.0]hexane, benzamide deriv.
CAS Registry Number 60129-53-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H24N4O6
InChI InChI=1S/C32H24N4O6/c37-28(21-10-4-1-5-11-21)36(29(38)22-12-6-2-7-13-22)27-24-16-17-35(26(24)33-20-34-27)30-25-32(42-25,18-40-30)19-41-31(39)23-14-8-3-9-15-23/h1-17,20,25,30H,18-19H2
InChIKey PNLWHDRRVUDZCM-UHFFFAOYSA-N
Molecular Weight 560.566 g/mol
SMILES C12(C(C([n]3c4c(c(N(C(=O)c5ccccc5)C(=O)c5ccccc5)ncn4)cc3)OC2)O1)COC(=O)c1ccccc1
SPLASH splash10-0bt9-0020970000-a411ec35a5ef10b444bb
Source of Spectrum I-55-1264-0
Synonyms Benzamide, N-[7-(2,3-anhydro-5-O-benzoyl-.beta.-D-ribofuranosyl)-7H-pyrrolo[2,3- d]pyrimidin-4-yl]-N-benzoyl- 4-N,N-dibenzimido-7-(5-O-benzoyl)-2,3-anhydro-.beta.-D-ribofuranosyl)pyrrolo(2,3-d)pyrimidine {4-[4-(dibenzoylamino)-7H-pyrrolo[2,3-d]pyrimidin-7-yl]-3,6-dioxabicyclo[3.1.0]hex-1-yl}methyl benzoate
Wiley ID 1406767