1,4-Anhydro-2,5-dideoxy-5-[(isopropylcarbamoyl)amino]-2-[(2-pyridinylmethyl)amino]-D-arabinitol

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Systematic / IUPAC Name: 1-[[(2R,3S,4R)-3-Hydroxy-4-(pyridin-2-ylmethylamino)oxolan-2-yl]methyl]-3-propan-2-ylurea

ID: Reference11812

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[[[(1-methylethyl)amino]carbonyl]amino]-2-[(2-pyridinylmethyl)amino]-;
NAT19-551716

Formula: C15H24N4O3

Spectral Data

1,4-Anhydro-2,5-dideoxy-5-[(isopropylcarbamoyl)amino]-2-[(2-pyridinylmethyl)amino]-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 650
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 10/3/2022 12:34:44 PM
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Identificators

InChI InChI=1S/C15H24N4O3/c1-10(2)19-15(21)18-8-13-14(20)12(9-22-13)17-7-11-5-3-4-6-16-11/h3-6,10,12-14,17,20H,7-9H2,1-2H3,(H2,18,19,21)/t12-,13-,14+/m1/s1
InChI Key MKAYCIKXSUEMGV-MCIONIFRSA-N
Canonical SMILES CC(C)NC(=O)NCC1C(C(CO1)NCC2=CC=CC=N2)O
CAS
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[[[(1-methylethyl)amino]carbonyl]amino]-2-[(2-pyridinylmethyl)amino]-;
NAT19-551716

In Other Databases

PubChem 75536728
ChemSpider 29858646