CID 201936

7157-31-5

Structural Information

Molecular Formula
C16H18N2O
SMILES
C1CC2=C(C3=CC=CC=C3N=C2C1)N4CCOCC4
InChI
InChI=1S/C16H18N2O/c1-2-6-14-12(4-1)16(18-8-10-19-11-9-18)13-5-3-7-15(13)17-14/h1-2,4,6H,3,5,7-11H2
InChIKey
AUFKTXNEJAAMFI-UHFFFAOYSA-N
Compound name
4-(2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

0
Patents

254.1419 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.149176 157.5
[M+Na]+ 277.131118 163.8
[M-H]- 253.134624 162.7
[M+NH4]+ 272.175723 173.7
[M+K]+ 293.105058 159.9
[M+H-H2O]+ 237.139160 148.2
[M+HCOO]- 299.140101 172.3
[M+CH3COO]- 313.155751 168.2
[M+Na-2H]- 275.116566 162.2
[M]+ 254.14135142 153.4
[M]- 254.14244858 153.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.