CID 47097

64057-92-7

Structural Information

Molecular Formula
C19H23N3O2
SMILES
CCN(CC)CCOC(=O)N1C2=C(C=C(C=C2)N)C3=CC=CC=C31
InChI
InChI=1S/C19H23N3O2/c1-3-21(4-2)11-12-24-19(23)22-17-8-6-5-7-15(17)16-13-14(20)9-10-18(16)22/h5-10,13H,3-4,11-12,20H2,1-2H3
InChIKey
UMLFVRLFYOMHDK-UHFFFAOYSA-N
Compound name
2-(diethylamino)ethyl 3-aminocarbazole-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.17902 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.186296 178.7
[M+Na]+ 348.168238 186.3
[M-H]- 324.171744 183.9
[M+NH4]+ 343.212843 195.5
[M+K]+ 364.142178 182.5
[M+H-H2O]+ 308.176280 170.3
[M+HCOO]- 370.177221 201.8
[M+CH3COO]- 384.192871 217.6
[M+Na-2H]- 346.153686 182.1
[M]+ 325.17847142 183.6
[M]- 325.17956858 183.6
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.