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

106
Patents

129.15175 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.15903 132.6
[M+Na]+ 152.14097 138.5
[M-H]- 128.14447 132.5
[M+NH4]+ 147.18557 154.6
[M+K]+ 168.11491 138.2
[M+H-H2O]+ 112.14901 128.4
[M+HCOO]- 174.14995 153.6
[M+CH3COO]- 188.16560 178.5
[M+Na-2H]- 150.12642 137.1
[M]+ 129.15120 131.7
[M]- 129.15230 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