CID 382590

Nsc670230

Structural Information

Molecular Formula
C17H14N2
SMILES
CC1=CC2=C3C=CC=CC3=NC2=C4C1=C(NC=C4)C
InChI
InChI=1S/C17H14N2/c1-10-9-14-12-5-3-4-6-15(12)19-17(14)13-7-8-18-11(2)16(10)13/h3-9,18H,1-2H3
InChIKey
NWFUMZFUBXELKR-UHFFFAOYSA-N
Compound name
4,5-dimethyl-3H-pyrido[4,3-a]carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.11569 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.12297 155.8
[M+Na]+ 269.10491 169.2
[M-H]- 245.10841 159.8
[M+NH4]+ 264.14951 175.6
[M+K]+ 285.07885 161.5
[M+H-H2O]+ 229.11295 148.1
[M+HCOO]- 291.11389 176.5
[M+CH3COO]- 305.12954 169.1
[M+Na-2H]- 267.09036 164.3
[M]+ 246.11514 159.1
[M]- 246.11624 159.1
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.