1,4-Anhydro-2-[(3-cyanobenzyl)amino]-5-[(cyclopentylcarbonyl)amino]-2,5-dideoxy-D-arabinitol

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Systematic / IUPAC Name: N-[[(2R,3S,4R)-4-[(3-Cyanophenyl)methylamino]-3-hydroxyoxolan-2-yl]methyl]cyclopentanecarboxamide

ID: Reference11329

Other Names: D-Arabinitol, 1,4-anhydro-2-[[(3-cyanophenyl)methyl]amino]-5-[(cyclopentylcarbonyl)amino]-2,5-dideoxy-;
NAT19-551236

Formula: C19H25N3O3

Spectral Data

1,4-Anhydro-2-[(3-cyanobenzyl)amino]-5-[(cyclopentylcarbonyl)amino]-2,5-dideoxy-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 1805
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 4/1/2022 9:18:21 AM
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Identificators

InChI InChI=1S/C19H25N3O3/c20-9-13-4-3-5-14(8-13)10-21-16-12-25-17(18(16)23)11-22-19(24)15-6-1-2-7-15/h3-5,8,15-18,21,23H,1-2,6-7,10-12H2,(H,22,24)/t16-,17-,18+/m1/s1
InChI Key DJIACLKOGJFVFJ-KURKYZTESA-N
Canonical SMILES C1CCC(C1)C(=O)NCC2C(C(CO2)NCC3=CC(=CC=C3)C#N)O
CAS
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Other Names D-Arabinitol, 1,4-anhydro-2-[[(3-cyanophenyl)methyl]amino]-5-[(cyclopentylcarbonyl)amino]-2,5-dideoxy-;
NAT19-551236

In Other Databases

ChemSpider 29858458
PubChem 75536569