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5-Aminotetrazole monohydrate

View entire compound with spectra: 4 NMR, 2 FTIR, and 1 Raman

5-Aminotetrazole monohydrate
SpectraBase Compound ID Xb8QdqO73e
InChI InChI=1S/CH3N5.H2O/c2-1-3-5-6-4-1;/h(H3,2,3,4,5,6);1H2
InChIKey JVSMPWHQUPKRNV-UHFFFAOYSA-N
Mol Weight 103.085 g/mol
Molecular Formula CH5N5O
Exact Mass 103.04941 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KX1dXqKF7Cl
Name 5-AMINO-1H-TETRAZOLE, MONOHYDRATE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula CH3N5 H2O
InChI InChI=1S/CH3N5.H2O/c2-1-3-5-6-4-1;/h(H3,2,3,4,5,6);1H2
InChIKey JVSMPWHQUPKRNV-UHFFFAOYSA-N
Melting Point 200-204C (dec.)
Molecular Weight 103.08
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 1H-TETRAZOLE, 5-AMINO-, MONOHYDRATE