CID 3062754

Jo 1332

Structural Information

Molecular Formula
C9H17N3
SMILES
CC(C)(CN(C)C)N1C=CN=C1
InChI
InChI=1S/C9H17N3/c1-9(2,7-11(3)4)12-6-5-10-8-12/h5-6,8H,7H2,1-4H3
InChIKey
OKWAQGLGGOCRCK-UHFFFAOYSA-N
Compound name
2-imidazol-1-yl-N,N,2-trimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

167.14224 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.14952 138.9
[M+Na]+ 190.13146 146.0
[M-H]- 166.13496 141.3
[M+NH4]+ 185.17606 159.1
[M+K]+ 206.10540 146.0
[M+H-H2O]+ 150.13950 131.6
[M+HCOO]- 212.14044 161.6
[M+CH3COO]- 226.15609 185.5
[M+Na-2H]- 188.11691 145.1
[M]+ 167.14169 140.6
[M]- 167.14279 140.6
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

patents stripe