CID 3080043

Brn 4266553

Structural Information

Molecular Formula
C19H21N3O
SMILES
CN(C)CCN1C2=C(C=CC1=O)C3=C(CC2)C4=CC=CC=C4N3
InChI
InChI=1S/C19H21N3O/c1-21(2)11-12-22-17-9-7-14-13-5-3-4-6-16(13)20-19(14)15(17)8-10-18(22)23/h3-6,8,10,20H,7,9,11-12H2,1-2H3
InChIKey
BNLLNQUTPSENBW-UHFFFAOYSA-N
Compound name
4-[2-(dimethylamino)ethyl]-6,11-dihydro-5H-pyrido[3,2-a]carbazol-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.16846 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.175736 172.3
[M+Na]+ 330.157678 181.8
[M-H]- 306.161184 176.3
[M+NH4]+ 325.202283 189.3
[M+K]+ 346.131618 175.5
[M+H-H2O]+ 290.165720 163.5
[M+HCOO]- 352.166661 191.1
[M+CH3COO]- 366.182311 183.3
[M+Na-2H]- 328.143126 177.7
[M]+ 307.16791142 174.5
[M]- 307.16900858 174.5
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

No patent data available for this compound.