CID 125440

Carbazole-1-acetic acid

Structural Information

Molecular Formula
C14H11NO2
SMILES
C1=CC=C2C(=C1)C3=CC=CC(=C3N2)CC(=O)O
InChI
InChI=1S/C14H11NO2/c16-13(17)8-9-4-3-6-11-10-5-1-2-7-12(10)15-14(9)11/h1-7,15H,8H2,(H,16,17)
InChIKey
APYYTORIICEPHE-UHFFFAOYSA-N
Compound name
2-(9H-carbazol-1-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

53
Patents

225.07898 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.086256 147.6
[M+Na]+ 248.068198 157.5
[M-H]- 224.071704 149.9
[M+NH4]+ 243.112803 167.2
[M+K]+ 264.042138 151.9
[M+H-H2O]+ 208.076240 141.5
[M+HCOO]- 270.077181 167.7
[M+CH3COO]- 284.092831 160.2
[M+Na-2H]- 246.053646 154.2
[M]+ 225.07843142 148.2
[M]- 225.07952858 148.2
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