CID 80098645

2839143-78-9

Structural Information

Molecular Formula
C10H19N3
SMILES
CCC(CC)N1C=C(C(=N1)C)CN
InChI
InChI=1S/C10H19N3/c1-4-10(5-2)13-7-9(6-11)8(3)12-13/h7,10H,4-6,11H2,1-3H3
InChIKey
QTQZGTNFIVGQBW-UHFFFAOYSA-N
Compound name
(3-methyl-1-pentan-3-ylpyrazol-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.1579 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.16518 143.1
[M+Na]+ 204.14712 153.2
[M+NH4]+ 199.19172 150.4
[M+K]+ 220.12106 149.5
[M-H]- 180.15062 143.8
[M+Na-2H]- 202.13257 147.2
[M]+ 181.15735 144.5
[M]- 181.15845 144.5
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.