CID 13976922

5-methoxy-1h-benzo[g]indole

Structural Information

Molecular Formula
C13H11NO
SMILES
COC1=CC2=C(C3=CC=CC=C31)NC=C2
InChI
InChI=1S/C13H11NO/c1-15-12-8-9-6-7-14-13(9)11-5-3-2-4-10(11)12/h2-8,14H,1H3
InChIKey
DGGPMXAQMFWTBH-UHFFFAOYSA-N
Compound name
5-methoxy-1H-benzo[g]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.08406 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.09134 139.9
[M+Na]+ 220.07328 151.0
[M-H]- 196.07678 143.7
[M+NH4]+ 215.11788 161.7
[M+K]+ 236.04722 145.9
[M+H-H2O]+ 180.08132 133.7
[M+HCOO]- 242.08226 162.6
[M+CH3COO]- 256.09791 154.0
[M+Na-2H]- 218.05873 148.7
[M]+ 197.08351 142.0
[M]- 197.08461 142.0
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

No patent data available for this compound.