(1S)-1,5-Anhydro-2,3,6-trideoxy-1-{[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl}-6-(isopropylamino)-D-erythro-hexitol

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Systematic / IUPAC Name: (2R,3S,6S)-6-[[5-(4-Fluorophenyl)-1,2-oxazol-3-yl]methyl]-2-[(propan-2-ylamino)methyl]oxan-3-ol

ID: Reference11218

Other Names: D-Arabino-heptitol, 2,6-anhydro-1,3,4,7-tetradeoxy-1-[5-(4-fluorophenyl)-3-isoxazolyl]-7-[(1-methylethyl)amino]-;
NAT12-540406

Formula: C19H25FN2O3

Spectral Data

(1S)-1,5-Anhydro-2,3,6-trideoxy-1-{[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl}-6-(isopropylamino)-D-erythro-hexitol 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 2335
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 2/18/2022 7:29:20 AM
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Identificators

InChI InChI=1S/C19H25FN2O3/c1-12(2)21-11-19-17(23)8-7-16(24-19)9-15-10-18(25-22-15)13-3-5-14(20)6-4-13/h3-6,10,12,16-17,19,21,23H,7-9,11H2,1-2H3/t16-,17-,19+/m0/s1
InChI Key GZZBPDPKKJJITF-JENIJYKNSA-N
Canonical SMILES CC(C)NCC1C(CCC(O1)CC2=NOC(=C2)C3=CC=C(C=C3)F)O
CAS
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Other Names D-Arabino-heptitol, 2,6-anhydro-1,3,4,7-tetradeoxy-1-[5-(4-fluorophenyl)-3-isoxazolyl]-7-[(1-methylethyl)amino]-;
NAT12-540406

In Other Databases

PubChem 75536266
ChemSpider 29856521