CID 54594690

2-(6-fluoro-1-methyl-1h-indol-3-yl)ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C11H13FN2
SMILES
CN1C=C(C2=C1C=C(C=C2)F)CCN
InChI
InChI=1S/C11H13FN2/c1-14-7-8(4-5-13)10-3-2-9(12)6-11(10)14/h2-3,6-7H,4-5,13H2,1H3
InChIKey
QAGABUCNXSEZHV-UHFFFAOYSA-N
Compound name
2-(6-fluoro-1-methylindol-3-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

192.10628 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.11356 139.0
[M+Na]+ 215.09550 150.1
[M-H]- 191.09900 141.5
[M+NH4]+ 210.14010 160.5
[M+K]+ 231.06944 145.8
[M+H-H2O]+ 175.10354 131.9
[M+HCOO]- 237.10448 163.1
[M+CH3COO]- 251.12013 187.4
[M+Na-2H]- 213.08095 144.5
[M]+ 192.10573 139.5
[M]- 192.10683 139.5
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