CID 13060

5-fluoro-beta-methyltryptamine hydrochloride

Structural Information

Molecular Formula
C11H13FN2
SMILES
CC(CN)C1=CNC2=C1C=C(C=C2)F
InChI
InChI=1S/C11H13FN2/c1-7(5-13)10-6-14-11-3-2-8(12)4-9(10)11/h2-4,6-7,14H,5,13H2,1H3
InChIKey
MKFCBKITBDKMET-UHFFFAOYSA-N
Compound name
2-(5-fluoro-1H-indol-3-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

192.10628 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.11356 139.8
[M+Na]+ 215.09550 151.2
[M+NH4]+ 210.14010 147.9
[M+K]+ 231.06944 146.7
[M-H]- 191.09900 140.5
[M+Na-2H]- 213.08095 145.1
[M]+ 192.10573 141.4
[M]- 192.10683 141.4
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