CID 39017

Carbazole, 2-chloro-7-methoxy-9-(2-pyrrolidinoethyl)-, hydrochloride

Structural Information

Molecular Formula
C19H21ClN2O
SMILES
COC1=CC2=C(C=C1)C3=C(N2CCN4CCCC4)C=C(C=C3)Cl
InChI
InChI=1S/C19H21ClN2O/c1-23-15-5-7-17-16-6-4-14(20)12-18(16)22(19(17)13-15)11-10-21-8-2-3-9-21/h4-7,12-13H,2-3,8-11H2,1H3
InChIKey
VRXRRXFSSPSLPX-UHFFFAOYSA-N
Compound name
2-chloro-7-methoxy-9-(2-pyrrolidin-1-ylethyl)carbazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

328.13425 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.14153 179.7
[M+Na]+ 351.12347 190.0
[M-H]- 327.12697 185.8
[M+NH4]+ 346.16807 197.8
[M+K]+ 367.09741 182.8
[M+H-H2O]+ 311.13151 171.3
[M+HCOO]- 373.13245 194.8
[M+CH3COO]- 387.14810 191.0
[M+Na-2H]- 349.10892 180.1
[M]+ 328.13370 184.2
[M]- 328.13480 184.2
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.