CID 3081211

1-mdpq

Structural Information

Molecular Formula
C20H21N3
SMILES
CC1=C2C(=CC=C1)C3=C(CCN3C4=CC=CC=C4C)C(=N2)NC
InChI
InChI=1S/C20H21N3/c1-13-7-4-5-10-17(13)23-12-11-16-19(23)15-9-6-8-14(2)18(15)22-20(16)21-3/h4-10H,11-12H2,1-3H3,(H,21,22)
InChIKey
XZENCZPCSRXPSL-UHFFFAOYSA-N
Compound name
N,6-dimethyl-1-(2-methylphenyl)-2,3-dihydropyrrolo[3,2-c]quinolin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

14
References

36
Patents

303.17355 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.18083 174.3
[M+Na]+ 326.16277 190.2
[M+NH4]+ 321.20737 184.0
[M+K]+ 342.13671 182.3
[M-H]- 302.16627 180.3
[M+Na-2H]- 324.14822 182.0
[M]+ 303.17300 178.5
[M]- 303.17410 178.5
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

patents stripe