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]+ 193.11356 139.3
[M+Na]+ 215.09550 150.0
[M-H]- 191.09900 140.4
[M+NH4]+ 210.14010 160.1
[M+K]+ 231.06944 144.8
[M+H-H2O]+ 175.10354 132.5
[M+HCOO]- 237.10448 161.9
[M+CH3COO]- 251.12013 184.8
[M+Na-2H]- 213.08095 144.4
[M]+ 192.10573 138.0
[M]- 192.10683 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