CID 12450937

67766-67-0

Structural Information

Molecular Formula
C5H10N4
SMILES
CCC1=NN(C(=N1)N)C
InChI
InChI=1S/C5H10N4/c1-3-4-7-5(6)9(2)8-4/h3H2,1-2H3,(H2,6,7,8)
InChIKey
GUYRJILQXBQXHO-UHFFFAOYSA-N
Compound name
5-ethyl-2-methyl-1,2,4-triazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

126.090546 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.09782 125.2
[M+Na]+ 149.07976 135.3
[M-H]- 125.08327 125.1
[M+NH4]+ 144.12437 145.2
[M+K]+ 165.05370 133.9
[M+H-H2O]+ 109.08781 117.8
[M+HCOO]- 171.08875 148.2
[M+CH3COO]- 185.10440 174.0
[M+Na-2H]- 147.06521 130.9
[M]+ 126.09000 124.9
[M]- 126.09109 124.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.