N-[[(2R,3S,6S)-6-[[5-(4-Fluorophenyl)-1,2-oxazol-3-yl]methyl]-3-hydroxyoxan-2-yl]methyl]-3,3-dimethylbutanamide

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Systematic / IUPAC Name: (1S)-1,5-Anhydro-2,3,6-trideoxy-6-[(3,3-dimethylbutanoyl)amino]-1-{[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl}-D-erythro-hexitol

ID: Reference13357

Other Names: NAT12-540341

Formula: C22H29FN2O4

Spectral Data

N-[[(2R,3S,6S)-6-[[5-(4-Fluorophenyl)-1,2-oxazol-3-yl]methyl]-3-hydroxyoxan-2-yl]methyl]-3,3-dimethylbutanamide 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 3387
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/11/2025 11:08:07 AM
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Identificators

InChI InChI=1S/C22H29FN2O4/c1-22(2,3)12-21(27)24-13-20-18(26)9-8-17(28-20)10-16-11-19(29-25-16)14-4-6-15(23)7-5-14/h4-7,11,17-18,20,26H,8-10,12-13H2,1-3H3,(H,24,27)/t17-,18-,20+/m0/s1
InChI Key SXDHVAWCRYBDJK-CMKODMSKSA-N
Canonical SMILES CC(C)(C)CC(=O)NCC1C(CCC(O1)CC2=NOC(=C2)C3=CC=C(C=C3)F)O
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Other Names NAT12-540341

In Other Databases

PubChem 75536239