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3-Isoxazolecarboxylic acid, 4,5-dihydro-, 2,6-bis(1,1-dimethylethyl)-4-methoxyphenyl ester, 2-oxide
SpectraBase Compound ID ElAcoZ66oyl
InChI InChI=1S/C19H27NO5/c1-18(2,3)13-10-12(23-7)11-14(19(4,5)6)16(13)25-17(21)15-8-9-24-20(15)22/h10-11H,8-9H2,1-7H3
InChIKey GYMDRWWJMKXQEI-UHFFFAOYSA-N
Mol Weight 349.43 g/mol
Molecular Formula C19H27NO5
Exact Mass 349.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JTYxzeWsVOD
Name 3-Isoxazolecarboxylic acid, 4,5-dihydro-, 2,6-bis(1,1-dimethylethyl)-4-methoxyphenyl ester, 2-oxide
CAS Registry Number 113719-13-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27NO5
InChI InChI=1S/C19H27NO5/c1-18(2,3)13-10-12(23-7)11-14(19(4,5)6)16(13)25-17(21)15-8-9-24-20(15)22/h10-11H,8-9H2,1-7H3
InChIKey GYMDRWWJMKXQEI-UHFFFAOYSA-N
Molecular Weight 349.427 g/mol
SMILES C1(=[N+](OCC1)[O-])C(Oc1c(C(C)(C)C)cc(cc1C(C)(C)C)OC)=O
SPLASH splash10-059l-9030000000-e95b09f202313441da38
Source of Spectrum H-70-1513-15
Synonyms 2,6-Ditert-butyl-4-methoxyphenyl 4,5-dihydro-3-isoxazolecarboxylate 2-oxide 3-{[2',6'-bis(1,1-dimethylethyl)-4'-methoxyphenyl]oxycarbonyl}-4,5-dihydroisoxazol-N-oxide
Wiley ID 1341379