CID 13755479

Octahydro-1h-indole-2-carboxamide

Structural Information

Molecular Formula
C9H16N2O
SMILES
C1CCC2C(C1)CC(N2)C(=O)N
InChI
InChI=1S/C9H16N2O/c10-9(12)8-5-6-3-1-2-4-7(6)11-8/h6-8,11H,1-5H2,(H2,10,12)
InChIKey
LGNJUPFFTXYXON-UHFFFAOYSA-N
Compound name
2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

168.12627 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.13355 138.4
[M+Na]+ 191.11549 142.6
[M-H]- 167.11899 138.5
[M+NH4]+ 186.16009 158.7
[M+K]+ 207.08943 139.9
[M+H-H2O]+ 151.12353 132.2
[M+HCOO]- 213.12447 154.7
[M+CH3COO]- 227.14012 177.6
[M+Na-2H]- 189.10094 140.1
[M]+ 168.12572 129.4
[M]- 168.12682 129.4
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