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3-(4-Tert-butylphenyl)-2-isoxazoline-5-carboxylic acid
SpectraBase Compound ID DCLsh0eCi0d
InChI InChI=1S/C14H17NO3/c1-14(2,3)10-6-4-9(5-7-10)11-8-12(13(16)17)18-15-11/h4-7,12H,8H2,1-3H3,(H,16,17)
InChIKey TVWVJHFPQYLLBC-UHFFFAOYSA-N
Mol Weight 247.29 g/mol
Molecular Formula C14H17NO3
Exact Mass 247.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID zD4fudZcrm
Name 3-(4-tert-butylphenyl)-2-isoxazoline-5-carboxylic acid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO3
InChI InChI=1S/C14H17NO3/c1-14(2,3)10-6-4-9(5-7-10)11-8-12(13(16)17)18-15-11/h4-7,12H,8H2,1-3H3,(H,16,17)
InChIKey TVWVJHFPQYLLBC-UHFFFAOYSA-N
Molecular Weight 247.294 g/mol
SMILES OC(C1ON=C(C1)c1ccc(C(C)(C)C)cc1)=O
SPLASH splash10-0gx1-0390000000-3e103f5f814839e8a641
Source of Spectrum QE-12-8578-25
Synonyms 3-(4-tert-butylphenyl)-4,5-dihydro-1,2-oxazole-5-carboxylic acid 3-(4-tert-butylphenyl)-4,5-dihydroisoxazole-5-carboxylic acid
Wiley ID 1587382