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

21
Patents

243.13716 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.144436 157.2
[M+Na]+ 266.126378 163.5
[M-H]- 242.129884 158.4
[M+NH4]+ 261.170983 170.4
[M+K]+ 282.100318 158.4
[M+H-H2O]+ 226.134420 147.1
[M+HCOO]- 288.135361 171.6
[M+CH3COO]- 302.151011 166.9
[M+Na-2H]- 264.111826 163.4
[M]+ 243.13661142 152.5
[M]- 243.13770858 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