CID 47102

Carbazole-9-carboxylic acid, 3-(diethylamino)propyl ester, hydrochloride

Structural Information

Molecular Formula
C20H24N2O2
SMILES
CCN(CC)CCCOC(=O)N1C2=CC=CC=C2C3=CC=CC=C31
InChI
InChI=1S/C20H24N2O2/c1-3-21(4-2)14-9-15-24-20(23)22-18-12-7-5-10-16(18)17-11-6-8-13-19(17)22/h5-8,10-13H,3-4,9,14-15H2,1-2H3
InChIKey
LSQKTDPBPMSAOF-UHFFFAOYSA-N
Compound name
3-(diethylamino)propyl carbazole-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.18378 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.191056 180.0
[M+Na]+ 347.172998 187.1
[M-H]- 323.176504 185.1
[M+NH4]+ 342.217603 197.1
[M+K]+ 363.146938 183.3
[M+H-H2O]+ 307.181040 171.3
[M+HCOO]- 369.181981 202.4
[M+CH3COO]- 383.197631 214.9
[M+Na-2H]- 345.158446 183.8
[M]+ 324.18323142 186.4
[M]- 324.18432858 186.4
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

No patent data available for this compound.