CID 617026

1,4,5,8,9-pentamethylcarbazole

Structural Information

Molecular Formula
C17H19N
SMILES
CC1=C2C3=C(C=CC(=C3N(C2=C(C=C1)C)C)C)C
InChI
InChI=1S/C17H19N/c1-10-6-8-12(3)16-14(10)15-11(2)7-9-13(4)17(15)18(16)5/h6-9H,1-5H3
InChIKey
LKVSJOBCOXSNCF-UHFFFAOYSA-N
Compound name
1,4,5,8,9-pentamethylcarbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

74
Patents

237.15175 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.159026 154.9
[M+Na]+ 260.140968 168.3
[M-H]- 236.144474 160.8
[M+NH4]+ 255.185573 177.0
[M+K]+ 276.114908 162.7
[M+H-H2O]+ 220.149010 148.8
[M+HCOO]- 282.149951 177.3
[M+CH3COO]- 296.165601 169.4
[M+Na-2H]- 258.126416 159.0
[M]+ 237.15120142 160.2
[M]- 237.15229858 160.2
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