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3-AP
SpectraBase Compound ID Gq0smgf8hHh
InChI InChI=1S/C7H9N5S/c8-5-2-1-3-10-6(5)4-11-12-7(9)13/h1-4H,8H2,(H3,9,12,13)/b11-4+
InChIKey XMYKNCNAZKMVQN-NYYWCZLTSA-N
Mol Weight 195.24 g/mol
Molecular Formula C7H9N5S
Exact Mass 195.057866 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 8V5ftppcD1O
Name 3-AP
Source of Sample Cayman Chemical Company
Catalog Number 15419
Lot Number 0460792-9
CAS Registry Number 143621-35-6
Cell Type Capillary tube
Compound Type Pure
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9N5S
IUPAC Name 2-[(3-Amino-2-pyridinyl)methylene]hydrazinecarbothioamide
InChI InChI=1S/C7H9N5S/c8-5-2-1-3-10-6(5)4-11-12-7(9)13/h1-4H,8H2,(H3,9,12,13)/b11-4+
InChIKey XMYKNCNAZKMVQN-NYYWCZLTSA-N
Molecular Weight 195.244 g/mol
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 903 mW
Raman Laser Source Nd:YAG
SMILES Nc1cccnc1\C=N\NC(N)=S
Scans Performed 2496
Source of Spectrum Forensic Spectral Research
Synonyms 3-Aminopyridine-2-carboxyaldehyde thiosemicarbazone; NSC 663249; Triapine
Technique FT-Raman