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Acetic acid (S)-1-methyl-2-(3-methyl-isoxazol-5-yl)-ethyl ester
SpectraBase Compound ID IF1d6hiqVSw
InChI InChI=1S/C9H13NO3/c1-6-4-9(13-10-6)5-7(2)12-8(3)11/h4,7H,5H2,1-3H3/t7-/m1/s1
InChIKey UZYROJQUAYZKTA-SSDOTTSWSA-N
Mol Weight 183.21 g/mol
Molecular Formula C9H13NO3
Exact Mass 183.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Evo7DhOvVOw
Name Acetic acid (S)-1-methyl-2-(3-methyl-isoxazol-5-yl)-ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NO3
InChI InChI=1S/C9H13NO3/c1-6-4-9(13-10-6)5-7(2)12-8(3)11/h4,7H,5H2,1-3H3/t7-/m1/s1
InChIKey UZYROJQUAYZKTA-SSDOTTSWSA-N
Molecular Weight 183.207 g/mol
SMILES c1(onc(c1)C)C[C@](OC(=O)C)(C)[H]
SPLASH splash10-0006-9000000000-04bbc810348cd1d98b16
Source of Spectrum QC-11-2574-4
Synonyms (1S)-1-methyl-2-(3-methyl-5-isoxazolyl)ethyl acetate (R)-5-(2-Acetylpropyl)-3-methylisoxazole Acetic acid (R)-1-methyl-2-(3-methyl-isoxazol-5-yl)-ethyl ester Acetic acid [(2R)-1-(3-methyl-5-isoxazolyl)propan-2-yl] ester [(2R)-1-(3-methyl-1,2-oxazol-5-yl)propan-2-yl] acetate [(1R)-1-methyl-2-(3-methylisoxazol-5-yl)ethyl] acetate [(2R)-1-(3-methyl-1,2-oxazol-5-yl)propan-2-yl] ethanoate
Wiley ID 859952