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5-(5-amino-3-methyl-4-isoxazolyl)-3,3-dimethylpentanoic acid methyl ester
SpectraBase Compound ID Bb4lbjc7w0H
InChI InChI=1S/C12H20N2O3/c1-8-9(11(13)17-14-8)5-6-12(2,3)7-10(15)16-4/h5-7,13H2,1-4H3
InChIKey SQGIUTQWAPXGOX-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C12H20N2O3
Exact Mass 240.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HfEszwsBYUV
Name 5-(5-amino-3-methyl-4-isoxazolyl)-3,3-dimethylpentanoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20N2O3
InChI InChI=1S/C12H20N2O3/c1-8-9(11(13)17-14-8)5-6-12(2,3)7-10(15)16-4/h5-7,13H2,1-4H3
InChIKey SQGIUTQWAPXGOX-UHFFFAOYSA-N
Molecular Weight 240.303 g/mol
SMILES Nc1c(c(no1)C)CCC(CC(=O)OC)(C)C
SPLASH splash10-08fr-5950000000-bd5285c3245c2962c21a
Source of Spectrum KC-0-1161-40
Synonyms 5-(5-amino-3-methyl-isoxazol-4-yl)-3,3-dimethyl-valeric acid methyl ester Methyl 5-(5-amino-3-methyl-1,2-oxazol-4-yl)-3,3-dimethylpentanoate Methyl 5-(5-amino-3-methyl-isoxazol-4-yl)-3,3-dimethyl-pentanoate Methyl 5-(5-azanyl-3-methyl-1,2-oxazol-4-yl)-3,3-dimethyl-pentanoate
Wiley ID 783740