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

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

ID: Reference11966

Other Names: D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(3,3-dimethyl-1-oxobutyl)amino]-2-(4-piperidinylamino)-;
NAT19-551062

Formula: C16H31N3O3

Spectral Data

1,4-Anhydro-2,5-dideoxy-5-[(3,3-dimethylbutanoyl)amino]-2-(4-piperidinylamino)-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 714
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/16/2022 10:32:47 AM
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Identificators

InChI InChI=1S/C16H31N3O3/c1-16(2,3)8-14(20)18-9-13-15(21)12(10-22-13)19-11-4-6-17-7-5-11/h11-13,15,17,19,21H,4-10H2,1-3H3,(H,18,20)/t12-,13-,15+/m1/s1
InChI Key MYPXLHMFEISPOL-NFAWXSAZSA-N
Canonical SMILES CC(C)(C)CC(=O)NCC1C(C(CO1)NC2CCNCC2)O
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Other Names D-Arabinitol, 1,4-anhydro-2,5-dideoxy-5-[(3,3-dimethyl-1-oxobutyl)amino]-2-(4-piperidinylamino)-;
NAT19-551062

In Other Databases

PubChem 75536516
ChemSpider 32034854