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4-acetyl-4-benzyl-2-methyloxazol-5(4H)-one
SpectraBase Compound ID 6kGcMlUBI9z
InChI InChI=1S/C13H13NO3/c1-9(15)13(12(16)17-10(2)14-13)8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3
InChIKey ZVLOUEGEVPOYGZ-UHFFFAOYSA-N
Mol Weight 231.25 g/mol
Molecular Formula C13H13NO3
Exact Mass 231.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CTTetQ5Im
Name 4-acetyl-4-benzyl-2-methyloxazol-5(4H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 231.089543280 u
Formula C13H13NO3
GC Oven Program Oven temp 250 oC
InChI InChI=1S/C13H13NO3/c1-9(15)13(12(16)17-10(2)14-13)8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3
InChIKey ZVLOUEGEVPOYGZ-UHFFFAOYSA-N
Instrument Name Hewlett Packard 5890-5971 GC
Ionization Type EI
Literature Reference DOI 10.1002/anie.201509863
Molecular Weight 231.251 g/mol
Quality 244
SMILES C1(=NC(C(O1)=O)(CC1=CC=CC=C1)C(=O)C)C
SPLASH splash10-00ku-6900000000-39239133b4e5659dcecf
Source of Spectrum ACI-55-SM11-6a (DOI: 10.1002/anie.201509863)
Wiley ID 1895311