CID 22676553

2,2,4-trimethylpentan-1-amine hydrochloride

Structural Information

Molecular Formula
C8H19N
SMILES
CC(C)CC(C)(C)CN
InChI
InChI=1S/C8H19N/c1-7(2)5-8(3,4)6-9/h7H,5-6,9H2,1-4H3
InChIKey
AKYZNGLLWXGHMQ-UHFFFAOYSA-N
Compound name
2,2,4-trimethylpentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

109
Patents

129.15175 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.159026 132.6
[M+Na]+ 152.140968 138.5
[M-H]- 128.144474 132.5
[M+NH4]+ 147.185573 154.6
[M+K]+ 168.114908 138.2
[M+H-H2O]+ 112.149010 128.4
[M+HCOO]- 174.149951 153.6
[M+CH3COO]- 188.165601 178.5
[M+Na-2H]- 150.126416 137.1
[M]+ 129.15120142 131.7
[M]- 129.15229858 131.7
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