CID 156596283

4,6,8-trimethylnonan-2-amine

Structural Information

Molecular Formula
C12H27N
SMILES
CC(C)CC(C)CC(C)CC(C)N
InChI
InChI=1S/C12H27N/c1-9(2)6-10(3)7-11(4)8-12(5)13/h9-12H,6-8,13H2,1-5H3
InChIKey
YYBVBQJAWFKRHA-UHFFFAOYSA-N
Compound name
4,6,8-trimethylnonan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.21436 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.221636 153.0
[M+Na]+ 208.203578 156.0
[M-H]- 184.207084 152.0
[M+NH4]+ 203.248183 172.3
[M+K]+ 224.177518 155.7
[M+H-H2O]+ 168.211620 147.5
[M+HCOO]- 230.212561 171.2
[M+CH3COO]- 244.228211 193.0
[M+Na-2H]- 206.189026 150.8
[M]+ 185.21381142 152.0
[M]- 185.21490858 152.0
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.