CID 76846849

1-(2,3-dihydro-1h-indol-6-yl)methanamine dihydrochloride

Structural Information

Molecular Formula
C9H12N2
SMILES
C1CNC2=C1C=CC(=C2)CN
InChI
InChI=1S/C9H12N2/c10-6-7-1-2-8-3-4-11-9(8)5-7/h1-2,5,11H,3-4,6,10H2
InChIKey
WMAWDZVEGVMXBP-UHFFFAOYSA-N
Compound name
2,3-dihydro-1H-indol-6-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

148.10005 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.10733 130.0
[M+Na]+ 171.08927 137.6
[M-H]- 147.09277 131.3
[M+NH4]+ 166.13387 151.8
[M+K]+ 187.06321 133.8
[M+H-H2O]+ 131.09731 124.0
[M+HCOO]- 193.09825 151.5
[M+CH3COO]- 207.11390 143.0
[M+Na-2H]- 169.07472 136.2
[M]+ 148.09950 125.4
[M]- 148.10060 125.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe