CID 38978

2-chloro-9-(2-dimethylaminoethyl)carbazole hydrochloride

Structural Information

Molecular Formula
C16H17ClN2
SMILES
CN(C)CCN1C2=CC=CC=C2C3=C1C=C(C=C3)Cl
InChI
InChI=1S/C16H17ClN2/c1-18(2)9-10-19-15-6-4-3-5-13(15)14-8-7-12(17)11-16(14)19/h3-8,11H,9-10H2,1-2H3
InChIKey
TUJICNBMVNBHKS-UHFFFAOYSA-N
Compound name
2-(2-chlorocarbazol-9-yl)-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.10803 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.11531 162.9
[M+Na]+ 295.09725 173.9
[M-H]- 271.10075 168.7
[M+NH4]+ 290.14185 183.6
[M+K]+ 311.07119 167.9
[M+H-H2O]+ 255.10529 155.8
[M+HCOO]- 317.10623 182.4
[M+CH3COO]- 331.12188 176.1
[M+Na-2H]- 293.08270 168.5
[M]+ 272.10748 169.2
[M]- 272.10858 169.2
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.