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2,5-Anhydro-1-deoxy-1-(2-pyridylamino)-D-mannitol

View entire compound with spectra: 1 NMR, and 1 FTIR

2,5-Anhydro-1-deoxy-1-(2-pyridylamino)-D-mannitol
SpectraBase Compound ID IWHvIFfMiqw
InChI InChI=1S/C11H16N2O4/c14-6-8-11(16)10(15)7(17-8)5-13-9-3-1-2-4-12-9/h1-4,7-8,10-11,14-16H,5-6H2,(H,12,13)
InChIKey GWFAXFAEIAPPDW-UHFFFAOYSA-N
Mol Weight 240.26 g/mol
Molecular Formula C11H16N2O4
Exact Mass 240.111007 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JyFsl0Qk7zD
Name 2,5-Anhydro-1-deoxy-1-(2-pyridylamino)-D-mannitol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 240.111006999 u
Formula C11H16N2O4
InChI InChI=1S/C11H16N2O4/c14-6-8-11(16)10(15)7(17-8)5-13-9-3-1-2-4-12-9/h1-4,7-8,10-11,14-16H,5-6H2,(H,12,13)
InChIKey GWFAXFAEIAPPDW-UHFFFAOYSA-N
Molecular Weight 240.259 g/mol
SMILES C(NC1=NC=CC=C1)C1C(C(O)C(O1)CO)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.863593