CID 104605457

2378501-99-4

Structural Information

Molecular Formula
C8H17N5
SMILES
CC(C)(C)NCC1=NN(C(=N1)N)C
InChI
InChI=1S/C8H17N5/c1-8(2,3)10-5-6-11-7(9)13(4)12-6/h10H,5H2,1-4H3,(H2,9,11,12)
InChIKey
YVWZLPVRKCUORX-UHFFFAOYSA-N
Compound name
5-[(tert-butylamino)methyl]-2-methyl-1,2,4-triazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.14839 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.15567 141.5
[M+Na]+ 206.13761 150.3
[M+NH4]+ 201.18221 147.5
[M+K]+ 222.11155 148.4
[M-H]- 182.14111 141.1
[M+Na-2H]- 204.12306 145.6
[M]+ 183.14784 142.2
[M]- 183.14894 142.2
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.