CID 708921

2-(7-fluoro-2-methyl-1h-indol-3-yl)ethan-1-amine

Structural Information

Molecular Formula
C11H13FN2
SMILES
CC1=C(C2=C(N1)C(=CC=C2)F)CCN
InChI
InChI=1S/C11H13FN2/c1-7-8(5-6-13)9-3-2-4-10(12)11(9)14-7/h2-4,14H,5-6,13H2,1H3
InChIKey
XNPHNSIBTGHUOJ-UHFFFAOYSA-N
Compound name
2-(7-fluoro-2-methyl-1H-indol-3-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

192.10628 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.113556 139.3
[M+Na]+ 215.095498 150.0
[M-H]- 191.099004 140.4
[M+NH4]+ 210.140103 160.1
[M+K]+ 231.069438 144.8
[M+H-H2O]+ 175.103540 132.5
[M+HCOO]- 237.104481 161.9
[M+CH3COO]- 251.120131 184.8
[M+Na-2H]- 213.080946 144.4
[M]+ 192.10573142 138.0
[M]- 192.10682858 138.0
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