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(Z)-2-(4-acetamidobenzylidene)-4-methyl-5-oxopyrazolidin-2-ium-1-ide
SpectraBase Compound ID LQXTqkWjFhf
InChI InChI=1S/C13H15N3O2/c1-9-7-16(15-13(9)18)8-11-3-5-12(6-4-11)14-10(2)17/h3-6,8-9H,7H2,1-2H3,(H,14,17)/b16-8-
InChIKey CHWBOAOOGGDUKV-PXNMLYILSA-N
Mol Weight 245.28 g/mol
Molecular Formula C13H15N3O2
Exact Mass 245.116427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I8EbMMCNViF
Name (Z)-2-(4-acetamidobenzylidene)-4-methyl-5-oxopyrazolidin-2-ium-1-ide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15N3O2
InChI InChI=1S/C13H15N3O2/c1-9-7-16(15-13(9)18)8-11-3-5-12(6-4-11)14-10(2)17/h3-6,8-9H,7H2,1-2H3,(H,14,17)/b16-8-
InChIKey CHWBOAOOGGDUKV-PXNMLYILSA-N
Molecular Weight 245.282 g/mol
SMILES N(c1ccc(cc1)\C=[N+]\1CC(C)C(=O)[N-]1)C(=O)C
SPLASH splash10-052e-7950000000-82672ea77e7ca3169f43
Source of Spectrum JX-2015-1-461
Wiley ID 1721289