CID 729801

2,3,4,9-tetrahydro-1h-carbazole-6-carboxylic acid

Structural Information

Molecular Formula
C13H13NO2
SMILES
C1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)O
InChI
InChI=1S/C13H13NO2/c15-13(16)8-5-6-12-10(7-8)9-3-1-2-4-11(9)14-12/h5-7,14H,1-4H2,(H,15,16)
InChIKey
OWQQDAGRTDUORV-UHFFFAOYSA-N
Compound name
6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

62
Patents

215.09464 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.10192 146.0
[M+Na]+ 238.08386 158.3
[M+NH4]+ 233.12846 154.8
[M+K]+ 254.05780 153.8
[M-H]- 214.08736 147.3
[M+Na-2H]- 236.06931 150.3
[M]+ 215.09409 147.9
[M]- 215.09519 147.9
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