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Byproduct 3 of APAAN hydrolysis AC
SpectraBase Compound ID 2cO4RSCgu2O
InChI InChI=1S/C21H19NO2/c1-14-19(17-10-6-4-7-11-17)15(2)22(16(3)23)21(24)20(14)18-12-8-5-9-13-18/h4-13H,1-3H3
InChIKey BLQSNWVQUVLEMI-UHFFFAOYSA-N
Mol Weight 317.39 g/mol
Molecular Formula C21H19NO2
Exact Mass 317.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4SCgnDnwYq
Name Byproduct 3 of APAAN hydrolysis AC
Classification Chemical for AM synthesis
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Exact Mass 317.141578854 u
Formula C21H19NO2
InChI InChI=1S/C21H19NO2/c1-14-19(17-10-6-4-7-11-17)15(2)22(16(3)23)21(24)20(14)18-12-8-5-9-13-18/h4-13H,1-3H3
InChIKey BLQSNWVQUVLEMI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 317.388 g/mol
SMILES c1c(C2=C(C)C(c3ccccc3)=C(N(C2=O)C(=O)C)C)cccc1
SPLASH splash10-00fr-0190000000-4da194c9476471bc92b8
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_10212