CID 28902304

N4-(pentan-3-yl)pyridine-3,4-diamine

Structural Information

Molecular Formula
C10H17N3
SMILES
CCC(CC)NC1=C(C=NC=C1)N
InChI
InChI=1S/C10H17N3/c1-3-8(4-2)13-10-5-6-12-7-9(10)11/h5-8H,3-4,11H2,1-2H3,(H,12,13)
InChIKey
HDNCIJPBJGEGIY-UHFFFAOYSA-N
Compound name
4-N-pentan-3-ylpyridine-3,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.14224 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.14952 141.7
[M+Na]+ 202.13146 147.7
[M-H]- 178.13496 143.4
[M+NH4]+ 197.17606 159.8
[M+K]+ 218.10540 145.5
[M+H-H2O]+ 162.13950 134.5
[M+HCOO]- 224.14044 165.1
[M+CH3COO]- 238.15609 188.1
[M+Na-2H]- 200.11691 147.1
[M]+ 179.14169 139.8
[M]- 179.14279 139.8
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.