1,4-Anhydro-2,5-dideoxy-5-[(3,3-dimethylbutanoyl)amino]-2-(tetrahydro-2H-pyran-4-ylamino)-D-arabinitol

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

ID: Reference11665

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(3,3-dimethyl-1-oxobutyl)amino]-2-[(tetrahydro-2H-pyran-4-yl)amino]-;
NAT19-551059

Formula: C16H30N2O4

Spectral Data

1,4-Anhydro-2,5-dideoxy-5-[(3,3-dimethylbutanoyl)amino]-2-(tetrahydro-2H-pyran-4-ylamino)-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 1399
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 8/16/2022 12:15:44 PM
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Identificators

InChI InChI=1S/C16H30N2O4/c1-16(2,3)8-14(19)17-9-13-15(20)12(10-22-13)18-11-4-6-21-7-5-11/h11-13,15,18,20H,4-10H2,1-3H3,(H,17,19)/t12-,13-,15+/m1/s1
InChI Key ASTQBFTWOJAJRP-NFAWXSAZSA-N
Canonical SMILES CC(C)(C)CC(=O)NCC1C(C(CO1)NC2CCOCC2)O
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(3,3-dimethyl-1-oxobutyl)amino]-2-[(tetrahydro-2H-pyran-4-yl)amino]-;
NAT19-551059

In Other Databases

ChemSpider 29858393
PubChem 75536514