CID 17040083

7-methoxy-4-(piperazin-1-yl)quinoline

Structural Information

Molecular Formula
C14H17N3O
SMILES
COC1=CC2=NC=CC(=C2C=C1)N3CCNCC3
InChI
InChI=1S/C14H17N3O/c1-18-11-2-3-12-13(10-11)16-5-4-14(12)17-8-6-15-7-9-17/h2-5,10,15H,6-9H2,1H3
InChIKey
UROPJUHDMCQLHY-UHFFFAOYSA-N
Compound name
7-methoxy-4-piperazin-1-ylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

243.13716 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.14444 157.2
[M+Na]+ 266.12638 163.5
[M-H]- 242.12988 158.4
[M+NH4]+ 261.17098 170.4
[M+K]+ 282.10032 158.4
[M+H-H2O]+ 226.13442 147.1
[M+HCOO]- 288.13536 171.6
[M+CH3COO]- 302.15101 166.9
[M+Na-2H]- 264.11183 163.4
[M]+ 243.13661 152.5
[M]- 243.13771 152.5
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