CID 61965175

4,5,6,7-tetrahydro-1h-indol-4-amine

Structural Information

Molecular Formula
C8H12N2
SMILES
C1CC(C2=C(C1)NC=C2)N
InChI
InChI=1S/C8H12N2/c9-7-2-1-3-8-6(7)4-5-10-8/h4-5,7,10H,1-3,9H2
InChIKey
XSHDKHHIMKMOFZ-UHFFFAOYSA-N
Compound name
4,5,6,7-tetrahydro-1H-indol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

136.10005 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.10733 127.3
[M+Na]+ 159.08927 134.2
[M-H]- 135.09277 128.4
[M+NH4]+ 154.13387 149.4
[M+K]+ 175.06321 130.9
[M+H-H2O]+ 119.09731 121.4
[M+HCOO]- 181.09825 147.6
[M+CH3COO]- 195.11390 140.1
[M+Na-2H]- 157.07472 132.9
[M]+ 136.09950 120.8
[M]- 136.10060 120.8
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

No patent data available for this compound.