CID 10354902

Ethyl 3-methyl-9h-carbazole-9-carboxylate

Structural Information

Molecular Formula
C16H15NO2
SMILES
CCOC(=O)N1C2=C(C=C(C=C2)C)C3=CC=CC=C31
InChI
InChI=1S/C16H15NO2/c1-3-19-16(18)17-14-7-5-4-6-12(14)13-10-11(2)8-9-15(13)17/h4-10H,3H2,1-2H3
InChIKey
OZYJBMQHTNVEAD-UHFFFAOYSA-N
Compound name
ethyl 3-methylcarbazole-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

253.11028 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.11756 157.2
[M+Na]+ 276.09950 168.1
[M-H]- 252.10300 162.3
[M+NH4]+ 271.14410 177.5
[M+K]+ 292.07344 163.8
[M+H-H2O]+ 236.10754 150.4
[M+HCOO]- 298.10848 179.6
[M+CH3COO]- 312.12413 170.7
[M+Na-2H]- 274.08495 162.8
[M]+ 253.10973 162.3
[M]- 253.11083 162.3
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