CID 168295320

Chembl5204925

Structural Information

Molecular Formula
C15H14N2
SMILES
CC1=CC2=NC(=C3C(=C2C=C1)C=CN3)C4CC4
InChI
InChI=1S/C15H14N2/c1-9-2-5-11-12-6-7-16-15(12)14(10-3-4-10)17-13(11)8-9/h2,5-8,10,16H,3-4H2,1H3
InChIKey
IESFOVVGSIOVPZ-UHFFFAOYSA-N
Compound name
4-cyclopropyl-7-methyl-3H-pyrrolo[2,3-c]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

222.11569 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.12297 152.7
[M+Na]+ 245.10491 165.6
[M-H]- 221.10841 158.5
[M+NH4]+ 240.14951 167.2
[M+K]+ 261.07885 158.1
[M+H-H2O]+ 205.11295 145.1
[M+HCOO]- 267.11389 173.3
[M+CH3COO]- 281.12954 165.2
[M+Na-2H]- 243.09036 159.1
[M]+ 222.11514 155.5
[M]- 222.11624 155.5
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.