1,4-Anhydro-2,5-dideoxy-5-(isonicotinoylamino)-2-(isopropylamino)-D-arabinitol

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Systematic / IUPAC Name: N-[[(2R,3S,4R)-3-Hydroxy-4-(propan-2-ylamino)oxolan-2-yl]methyl]pyridine-4-carboxamide

ID: Reference11621

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(1-methylethyl)amino]-5-[(4-pyridinylcarbonyl)amino]-;
NAT19-553964

Formula: C14H21N3O3

Spectral Data

1,4-Anhydro-2,5-dideoxy-5-(isonicotinoylamino)-2-(isopropylamino)-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 605
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 8/2/2022 8:13:44 AM
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Identificators

InChI InChI=1S/C14H21N3O3/c1-9(2)17-11-8-20-12(13(11)18)7-16-14(19)10-3-5-15-6-4-10/h3-6,9,11-13,17-18H,7-8H2,1-2H3,(H,16,19)/t11-,12-,13+/m1/s1
InChI Key CZDBXBFJVFJALS-UPJWGTAASA-N
Canonical SMILES CC(C)NC1COC(C1O)CNC(=O)C2=CC=NC=C2
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(1-methylethyl)amino]-5-[(4-pyridinylcarbonyl)amino]-;
NAT19-553964

In Other Databases

PubChem 75536786
ChemSpider 29858713