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]+ 139.097826 133.7
[M+Na]+ 161.079768 145.0
[M-H]- 137.083274 136.2
[M+NH4]+ 156.124373 147.6
[M+K]+ 177.053708 140.1
[M+H-H2O]+ 121.087810 126.0
[M+HCOO]- 183.088751 155.5
[M+CH3COO]- 197.104401 146.4
[M+Na-2H]- 159.065216 138.3
[M]+ 138.09000142 133.1
[M]- 138.09109858 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.