CID 18329069

2h,6h-[1,3]dioxolo[4,5-e]indole-7-carboxylicacid

Structural Information

Molecular Formula
C10H7NO4
SMILES
C1OC2=C(O1)C3=C(C=C2)NC(=C3)C(=O)O
InChI
InChI=1S/C10H7NO4/c12-10(13)7-3-5-6(11-7)1-2-8-9(5)15-4-14-8/h1-3,11H,4H2,(H,12,13)
InChIKey
LXDZNVVODQUNEM-UHFFFAOYSA-N
Compound name
6H-[1,3]dioxolo[4,5-e]indole-7-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

205.0375 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.04478 137.8
[M+Na]+ 228.02672 148.3
[M-H]- 204.03022 141.8
[M+NH4]+ 223.07132 157.3
[M+K]+ 244.00066 147.2
[M+H-H2O]+ 188.03476 133.7
[M+HCOO]- 250.03570 157.1
[M+CH3COO]- 264.05135 151.8
[M+Na-2H]- 226.01217 144.4
[M]+ 205.03695 140.7
[M]- 205.03805 140.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe