1,4-Anhydro-2,5-dideoxy-5-[(3,3-dimethylbutanoyl)amino]-2-{[(1-methyl-1H-imidazol-2-yl)methyl]amino}-D-arabinitol

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Systematic / IUPAC Name: N-[[(2R,3S,4R)-3-Hydroxy-4-[(1-methylimidazol-2-yl)methylamino]oxolan-2-yl]methyl]-3,3-dimethylbutanamide

ID: Reference11732

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(3,3-dimethyl-1-oxobutyl)amino]-2-[[(1-methyl-1H-imidazol-2-yl)methyl]amino]-;
NAT19-551084

Formula: C16H28N4O3

Spectral Data

1,4-Anhydro-2,5-dideoxy-5-[(3,3-dimethylbutanoyl)amino]-2-{[(1-methyl-1H-imidazol-2-yl)methyl]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 735
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 9/8/2022 7:39:15 AM
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Identificators

InChI InChI=1S/C16H28N4O3/c1-16(2,3)7-14(21)19-8-12-15(22)11(10-23-12)18-9-13-17-5-6-20(13)4/h5-6,11-12,15,18,22H,7-10H2,1-4H3,(H,19,21)/t11-,12-,15+/m1/s1
InChI Key FNMPYYNWCPKUQH-JMSVASOKSA-N
Canonical SMILES CC(C)(C)CC(=O)NCC1C(C(CO1)NCC2=NC=CN2C)O
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(3,3-dimethyl-1-oxobutyl)amino]-2-[[(1-methyl-1H-imidazol-2-yl)methyl]amino]-;
NAT19-551084

In Other Databases

ChemSpider 29858409
PubChem 75536529