CID 14353

9-(2-chloroethyl)carbazole

Structural Information

Molecular Formula
C14H12ClN
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3N2CCCl
InChI
InChI=1S/C14H12ClN/c15-9-10-16-13-7-3-1-5-11(13)12-6-2-4-8-14(12)16/h1-8H,9-10H2
InChIKey
CVSBRGRSQUGIKO-UHFFFAOYSA-N
Compound name
9-(2-chloroethyl)carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

69
Patents

229.06583 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.07311 148.9
[M+Na]+ 252.05505 160.8
[M-H]- 228.05855 153.4
[M+NH4]+ 247.09965 170.9
[M+K]+ 268.02899 154.0
[M+H-H2O]+ 212.06309 142.6
[M+HCOO]- 274.06403 167.8
[M+CH3COO]- 288.07968 162.8
[M+Na-2H]- 250.04050 156.8
[M]+ 229.06528 153.6
[M]- 229.06638 153.6
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