CID 414233

6633-18-7

Structural Information

Molecular Formula
C17H25N3
SMILES
CC(C)NCCCCCNC1=CC=CC2=C1N=CC=C2
InChI
InChI=1S/C17H25N3/c1-14(2)18-11-4-3-5-12-19-16-10-6-8-15-9-7-13-20-17(15)16/h6-10,13-14,18-19H,3-5,11-12H2,1-2H3
InChIKey
YZWOMVXWGMUEJN-UHFFFAOYSA-N
Compound name
N'-propan-2-yl-N-quinolin-8-ylpentane-1,5-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.20483 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.21211 166.3
[M+Na]+ 294.19405 170.6
[M-H]- 270.19755 168.3
[M+NH4]+ 289.23865 181.7
[M+K]+ 310.16799 166.1
[M+H-H2O]+ 254.20209 157.6
[M+HCOO]- 316.20303 187.8
[M+CH3COO]- 330.21868 207.2
[M+Na-2H]- 292.17950 172.5
[M]+ 271.20428 166.6
[M]- 271.20538 166.6
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.