CID 55300242

865375-46-8

Structural Information

Molecular Formula
C10H9N
SMILES
C=CC1=CC2=C(C=C1)C=CN2
InChI
InChI=1S/C10H9N/c1-2-8-3-4-9-5-6-11-10(9)7-8/h2-7,11H,1H2
InChIKey
MDAMSCNARAPEIQ-UHFFFAOYSA-N
Compound name
6-ethenyl-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

143.0735 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.08078 126.9
[M+Na]+ 166.06272 137.3
[M-H]- 142.06622 129.4
[M+NH4]+ 161.10732 149.7
[M+K]+ 182.03666 132.7
[M+H-H2O]+ 126.07076 121.3
[M+HCOO]- 188.07170 150.8
[M+CH3COO]- 202.08735 141.5
[M+Na-2H]- 164.04817 135.2
[M]+ 143.07295 126.6
[M]- 143.07405 126.6
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