CID 38964

41734-61-6

Structural Information

Molecular Formula
C18H23ClN2
SMILES
C1CCC2=C(C1)C3=C(N2CCN4CCCC4)C=CC(=C3)Cl
InChI
InChI=1S/C18H23ClN2/c19-14-7-8-18-16(13-14)15-5-1-2-6-17(15)21(18)12-11-20-9-3-4-10-20/h7-8,13H,1-6,9-12H2
InChIKey
HNVXOFISTYQAQP-UHFFFAOYSA-N
Compound name
6-chloro-9-(2-pyrrolidin-1-ylethyl)-1,2,3,4-tetrahydrocarbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.15497 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.16225 174.7
[M+Na]+ 325.14419 182.6
[M-H]- 301.14769 179.6
[M+NH4]+ 320.18879 193.4
[M+K]+ 341.11813 175.3
[M+H-H2O]+ 285.15223 166.0
[M+HCOO]- 347.15317 187.1
[M+CH3COO]- 361.16882 185.0
[M+Na-2H]- 323.12964 174.1
[M]+ 302.15442 174.0
[M]- 302.15552 174.0
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

No patent data available for this compound.