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Articaine AC
SpectraBase Compound ID 52zgi1LHr6r
InChI InChI=1S/C15H22N2O4S/c1-6-7-17(11(4)18)10(3)14(19)16-12-9(2)8-22-13(12)15(20)21-5/h8,10H,6-7H2,1-5H3,(H,16,19)
InChIKey PBDWJDRCHHFXLR-UHFFFAOYSA-N
Mol Weight 326.41 g/mol
Molecular Formula C15H22N2O4S
Exact Mass 326.130028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5YxuIJaGn5c
Name Articaine AC
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 326.130028366 u
Formula C15H22N2O4S
InChI InChI=1S/C15H22N2O4S/c1-6-7-17(11(4)18)10(3)14(19)16-12-9(2)8-22-13(12)15(20)21-5/h8,10H,6-7H2,1-5H3,(H,16,19)
InChIKey PBDWJDRCHHFXLR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 326.411 g/mol
Nominal Mass 326 u
Quality 996
Retention Index 2412
SMILES C1(=C(C(OC)=O)SC=C1C)NC(C(N(C(=O)C)CCC)C)=O
SPLASH splash10-052r-9500000000-db4b3defaeb888dc3ef2
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms methyl 3-((2-(acetyl(propyl)amino)propanoyl)amino)-4-methylthiophene-2-carboxylate
Technique GC/MS
Wiley ID DD2024_033184