CID 22282699

1,6,7,8-tetrahydrocyclopenta[g]indole

Structural Information

Molecular Formula
C11H11N
SMILES
C1CC2=C(C1)C3=C(C=C2)C=CN3
InChI
InChI=1S/C11H11N/c1-2-8-4-5-9-6-7-12-11(9)10(8)3-1/h4-7,12H,1-3H2
InChIKey
OGAMTYAYYRHIKY-UHFFFAOYSA-N
Compound name
1,6,7,8-tetrahydrocyclopenta[g]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

46
Patents

157.08914 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.09642 131.3
[M+Na]+ 180.07836 141.3
[M-H]- 156.08186 134.8
[M+NH4]+ 175.12296 156.2
[M+K]+ 196.05230 136.8
[M+H-H2O]+ 140.08640 126.0
[M+HCOO]- 202.08734 153.9
[M+CH3COO]- 216.10299 145.7
[M+Na-2H]- 178.06381 138.0
[M]+ 157.08859 130.3
[M]- 157.08969 130.3
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