CID 3378219

1184994-08-8

Structural Information

Molecular Formula
C9H17N3
SMILES
CC(C)(C)C(CN1C=CC=N1)N
InChI
InChI=1S/C9H17N3/c1-9(2,3)8(10)7-12-6-4-5-11-12/h4-6,8H,7,10H2,1-3H3
InChIKey
UCFRIJLZCCWFHR-UHFFFAOYSA-N
Compound name
3,3-dimethyl-1-pyrazol-1-ylbutan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.14224 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.149516 140.2
[M+Na]+ 190.131458 147.0
[M-H]- 166.134964 140.7
[M+NH4]+ 185.176063 159.5
[M+K]+ 206.105398 145.7
[M+H-H2O]+ 150.139500 133.2
[M+HCOO]- 212.140441 160.7
[M+CH3COO]- 226.156091 181.4
[M+Na-2H]- 188.116906 144.8
[M]+ 167.14169142 138.9
[M]- 167.14278858 138.9
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.