CID 94191683

1909293-79-3

Structural Information

Molecular Formula
C6H10N4
SMILES
C[C@@H]1C[C@H]1C2=NC(=NN2)N
InChI
InChI=1S/C6H10N4/c1-3-2-4(3)5-8-6(7)10-9-5/h3-4H,2H2,1H3,(H3,7,8,9,10)/t3-,4-/m1/s1
InChIKey
GILLLQJMOROSSS-QWWZWVQMSA-N
Compound name
5-[(1R,2R)-2-methylcyclopropyl]-1H-1,2,4-triazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

138.09055 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.09783 133.7
[M+Na]+ 161.07977 145.0
[M-H]- 137.08327 136.2
[M+NH4]+ 156.12437 147.6
[M+K]+ 177.05371 140.1
[M+H-H2O]+ 121.08781 126.0
[M+HCOO]- 183.08875 155.5
[M+CH3COO]- 197.10440 146.4
[M+Na-2H]- 159.06522 138.3
[M]+ 138.09000 133.1
[M]- 138.09110 133.1
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.