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4-Methyl-2-oxotetrahydro-2H-pyran-4-yl acetate (D2)
SpectraBase Compound ID DeJnwNW5Hy7
InChI InChI=1S/C8H12O4/c1-6(9)12-8(2)3-4-11-7(10)5-8/h3-5H2,1-2H3
InChIKey UISGYVLMJZLIIC-UHFFFAOYSA-N
Mol Weight 172.18 g/mol
Molecular Formula C8H12O4
Exact Mass 172.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6WrGalMIzIt
Name 4-Methyl-2-oxotetrahydro-2H-pyran-4-yl acetate
CAS Registry Number 83191-98-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O4
InChI InChI=1S/C8H12O4/c1-6(9)12-8(2)3-4-11-7(10)5-8/h3-5H2,1-2H3
InChIKey UISGYVLMJZLIIC-UHFFFAOYSA-N
Molecular Weight 172.180 g/mol
SMILES C1(OCCC(C1)(C)OC(=O)C)=O
SPLASH splash10-0gx0-9100000000-36aacdb0b49f51c82043
Synonyms (4-methyl-2-oxidanylidene-oxan-4-yl) ethanoate (4-methyl-2-oxo-tetrahydropyran-4-yl) acetate (4-methyl-2-oxooxan-4-yl) acetate Acetic acid (2-keto-4-methyl-tetrahydropyran-4-yl) ester Acetic acid (4-methyl-2-oxo-4-oxanyl) ester Acetic acid, 4-methyl-2-oxotetrahydropyran-4-yl ester
Wiley ID 1483955