CID 38987

41734-73-0

Structural Information

Molecular Formula
C17H19ClN2
SMILES
CN(C)CCCN1C2=C(C=C(C=C2)Cl)C3=CC=CC=C31
InChI
InChI=1S/C17H19ClN2/c1-19(2)10-5-11-20-16-7-4-3-6-14(16)15-12-13(18)8-9-17(15)20/h3-4,6-9,12H,5,10-11H2,1-2H3
InChIKey
DIVSTQUAADNJAJ-UHFFFAOYSA-N
Compound name
3-(3-chlorocarbazol-9-yl)-N,N-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

286.1237 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.13098 167.7
[M+Na]+ 309.11292 178.2
[M-H]- 285.11642 173.3
[M+NH4]+ 304.15752 187.8
[M+K]+ 325.08686 172.0
[M+H-H2O]+ 269.12096 160.4
[M+HCOO]- 331.12190 186.9
[M+CH3COO]- 345.13755 180.4
[M+Na-2H]- 307.09837 172.8
[M]+ 286.12315 174.4
[M]- 286.12425 174.4
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

patents stripe