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

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

ID: Reference11792

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(4,4-difluorocyclohexyl)amino]-5-[(2-methoxyacetyl)amino]-;
NAT19-551263

Formula: C14H24F2N2O4

Spectral Data

1,4-Anhydro-2,5-dideoxy-2-[(4,4-difluorocyclohexyl)amino]-5-[(methoxyacetyl)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 1542
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 9/29/2022 8:19:56 AM
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Identificators

InChI InChI=1S/C14H24F2N2O4/c1-21-8-12(19)17-6-11-13(20)10(7-22-11)18-9-2-4-14(15,16)5-3-9/h9-11,13,18,20H,2-8H2,1H3,(H,17,19)/t10-,11-,13+/m1/s1
InChI Key GSYSIOSTPDYEAI-WZRBSPASSA-N
Canonical SMILES COCC(=O)NCC1C(C(CO1)NC2CCC(CC2)(F)F)O
CAS
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-2-[(4,4-difluorocyclohexyl)amino]-5-[(2-methoxyacetyl)amino]-;
NAT19-551263

In Other Databases

ChEMBL CHEMBL3436945
PubChem 75536576
ChemSpider 29858468