CID 219301

3-(9h-carbazol-9-yl)propanoic acid

Structural Information

Molecular Formula
C15H13NO2
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3N2CCC(=O)O
InChI
InChI=1S/C15H13NO2/c17-15(18)9-10-16-13-7-3-1-5-11(13)12-6-2-4-8-14(12)16/h1-8H,9-10H2,(H,17,18)
InChIKey
ZAJJJOMMWPVJMH-UHFFFAOYSA-N
Compound name
3-carbazol-9-ylpropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

439
Patents

239.09464 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.10192 152.2
[M+Na]+ 262.08386 162.1
[M-H]- 238.08736 155.7
[M+NH4]+ 257.12846 171.9
[M+K]+ 278.05780 157.1
[M+H-H2O]+ 222.09190 145.6
[M+HCOO]- 284.09284 173.5
[M+CH3COO]- 298.10849 165.1
[M+Na-2H]- 260.06931 158.7
[M]+ 239.09409 155.0
[M]- 239.09519 155.0
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

patents stripe