CID 6453029

54561-96-5

Structural Information

Molecular Formula
C9H21N
SMILES
CC(C)C(C(C)C)N(C)C
InChI
InChI=1S/C9H21N/c1-7(2)9(8(3)4)10(5)6/h7-9H,1-6H3
InChIKey
SWIVDNYSVCBPDH-UHFFFAOYSA-N
Compound name
N,N,2,4-tetramethylpentan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

143.1674 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.17468 137.3
[M+Na]+ 166.15662 142.0
[M-H]- 142.16012 138.9
[M+NH4]+ 161.20122 159.4
[M+K]+ 182.13056 143.8
[M+H-H2O]+ 126.16466 132.2
[M+HCOO]- 188.16560 158.7
[M+CH3COO]- 202.18125 187.4
[M+Na-2H]- 164.14207 138.5
[M]+ 143.16685 138.3
[M]- 143.16795 138.3
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