1,4-Anhydro-2,5-dideoxy-2-[(4,4-difluorocyclohexyl)amino]-5-(isonicotinoylamino)-D-arabinitol

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Systematic / IUPAC Name: N-[[(2R,3S,4R)-4-[(4,4-Difluorocyclohexyl)amino]-3-hydroxyoxolan-2-yl]methyl]pyridine-4-carboxamide

ID: Reference11423

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(4,4-difluorocyclohexyl)amino]-5-[(4-pyridinylcarbonyl)amino]-;
NAT19-553975

Formula: C17H23F2N3O3

Spectral Data

1,4-Anhydro-2,5-dideoxy-2-[(4,4-difluorocyclohexyl)amino]-5-(isonicotinoylamino)-D-arabinitol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 2581
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 5/30/2022 11:59:16 AM
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Identificators

InChI InChI=1S/C17H23F2N3O3/c18-17(19)5-1-12(2-6-17)22-13-10-25-14(15(13)23)9-21-16(24)11-3-7-20-8-4-11/h3-4,7-8,12-15,22-23H,1-2,5-6,9-10H2,(H,21,24)/t13-,14-,15+/m1/s1
InChI Key GIASGVZVXDERQI-KFWWJZLASA-N
Canonical SMILES C1CC(CCC1NC2COC(C2O)CNC(=O)C3=CC=NC=C3)(F)F
CAS
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(4,4-difluorocyclohexyl)amino]-5-[(4-pyridinylcarbonyl)amino]-;
NAT19-553975

In Other Databases

PubChem 75536792
ChemSpider 29858721