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N-Benzoyl-3-(4,4-dimethyl-2,6-dioxocyclohexylidene)alanine
SpectraBase Compound ID LqFn04eViGT
InChI InChI=1S/C18H19NO5/c1-18(2)9-14(20)12(15(21)10-18)8-13(17(23)24)19-16(22)11-6-4-3-5-7-11/h3-8,13H,9-10H2,1-2H3,(H,19,22)(H,23,24)
InChIKey JVTGPFGLNYBIEX-UHFFFAOYSA-N
Mol Weight 329.35 g/mol
Molecular Formula C18H19NO5
Exact Mass 329.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9Lg8AO3jLU
Name N-Benzoyl-3-(4,4-dimethyl-2,6-dioxocyclohexylidene)alanine
Comments Less than 3 mono-isotopic peaks
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Formula C18H19NO5
InChI InChI=1S/C18H19NO5/c1-18(2)9-14(20)12(15(21)10-18)8-13(17(23)24)19-16(22)11-6-4-3-5-7-11/h3-8,13H,9-10H2,1-2H3,(H,19,22)(H,23,24)
InChIKey JVTGPFGLNYBIEX-UHFFFAOYSA-N
Molecular Weight 329.352 g/mol
SMILES N(C(=O)c1ccccc1)C(C(=O)O)C=C1C(CC(CC1=O)(C)C)=O
SPLASH splash10-0a4i-0920000000-e189daa9a73abc8ea6a8
Source of Spectrum O1-59-132-3
Wiley ID 1591885