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(3,4,4-trimethyl-5H-1,2-oxazol-5-yl) acetate
SpectraBase Compound ID 21268JCzcdF
InChI InChI=1S/C8H13NO3/c1-5-8(3,4)7(12-9-5)11-6(2)10/h7H,1-4H3
InChIKey XCUSJKNNYUAWJT-UHFFFAOYSA-N
Mol Weight 171.2 g/mol
Molecular Formula C8H13NO3
Exact Mass 171.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ElCrRc7jJ4A
Name (3,4,4-trimethyl-5H-1,2-oxazol-5-yl) acetate
CAS Registry Number 99390-67-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NO3
InChI InChI=1S/C8H13NO3/c1-5-8(3,4)7(12-9-5)11-6(2)10/h7H,1-4H3
InChIKey XCUSJKNNYUAWJT-UHFFFAOYSA-N
Molecular Weight 171.196 g/mol
SMILES C1(C(ON=C1C)OC(=O)C)(C)C
SPLASH splash10-0089-9200000000-43e01195d18bfb1a8f17
Source of Spectrum Y-22-295-8
Synonyms (3,4,4-trimethyl-5H-1,2-oxazol-5-yl) ethanoate (3,4,4-trimethyl-5H-isoxazol-5-yl) acetate Acetic acid (3,4,4-trimethyl-2-isoxazolin-5-yl) ester Acetic acid (3,4,4-trimethyl-5H-isoxazol-5-yl) ester
Wiley ID 1167881