CID 20205600

(3-aminopropyl)(methyl)(2-methylpropyl)amine

Structural Information

Molecular Formula
C8H20N2
SMILES
CC(C)CN(C)CCCN
InChI
InChI=1S/C8H20N2/c1-8(2)7-10(3)6-4-5-9/h8H,4-7,9H2,1-3H3
InChIKey
IUOMCBLLCDSYCD-UHFFFAOYSA-N
Compound name
N'-methyl-N'-(2-methylpropyl)propane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

144.16264 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.16992 137.5
[M+Na]+ 167.15186 142.1
[M-H]- 143.15536 138.4
[M+NH4]+ 162.19646 158.9
[M+K]+ 183.12580 142.8
[M+H-H2O]+ 127.15990 131.8
[M+HCOO]- 189.16084 161.5
[M+CH3COO]- 203.17649 186.6
[M+Na-2H]- 165.13731 140.7
[M]+ 144.16209 137.5
[M]- 144.16319 137.5
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