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Pentylenetetrazole
SpectraBase Compound ID JXPJycEqmzC
InChI InChI=1S/C6H10N4/c1-2-4-6-7-8-9-10(6)5-3-1/h1-5H2
InChIKey CWRVKFFCRWGWCS-UHFFFAOYSA-N
Mol Weight 138.17 g/mol
Molecular Formula C6H10N4
Exact Mass 138.090546 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 4ChxHSanots
Name Pentylenetetrazole
Source of Sample Cayman Chemical Company
Catalog Number 18682
Lot Number 0475598-1
Acronyms PTZ
CAS Registry Number 54-95-5
Cell Type NMR tube
Compound Type Pure
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H10N4
IUPAC Name 6,7,8,9-Tetrahydro-5H-etrazolo[1,5-a]azepine
InChI InChI=1S/C6H10N4/c1-2-4-6-7-8-9-10(6)5-3-1/h1-5H2
InChIKey CWRVKFFCRWGWCS-UHFFFAOYSA-N
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 597 mW
Raman Laser Source Nd:YAG
SMILES c12nnn[n]2CCCCC1
Scans Performed 2048
Source of Spectrum Forensic Spectral Research
Synonyms α,β-Cyclopentamethylenetetrazole; 1,5-Pentamethylenetetrazole; NSC 5729; NSC 66489
Technique FT-Raman