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

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

ID: Reference11275

Other Names: D-Arabinitol, 1,4-anhydro-5-[(cyclopentylcarbonyl)amino]-2,5-dideoxy-2-[(4,4-difluorocyclohexyl)amino]-;
NAT19-551213

Formula: C17H28F2N2O3

Spectral Data

1,4-Anhydro-5-[(cyclopentylcarbonyl)amino]-2,5-dideoxy-2-[(4,4-difluorocyclohexyl)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 1703
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/11/2022 10:42:40 AM
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Identificators

InChI InChI=1S/C17H28F2N2O3/c18-17(19)7-5-12(6-8-17)21-13-10-24-14(15(13)22)9-20-16(23)11-3-1-2-4-11/h11-15,21-22H,1-10H2,(H,20,23)/t13-,14-,15+/m1/s1
InChI Key RMFBUBMUUWOYRL-KFWWJZLASA-N
Canonical SMILES C1CCC(C1)C(=O)NCC2C(C(CO2)NC3CCC(CC3)(F)F)O
CAS
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Other Names D-Arabinitol, 1,4-anhydro-5-[(cyclopentylcarbonyl)amino]-2,5-dideoxy-2-[(4,4-difluorocyclohexyl)amino]-;
NAT19-551213

In Other Databases

PubChem 75536557
ChemSpider 29858444
ChEMBL CHEMBL3436915