CID 11228897

5-fluoro-2-methyl-2,3-dihydro-1h-indole

Structural Information

Molecular Formula
C9H10FN
SMILES
CC1CC2=C(N1)C=CC(=C2)F
InChI
InChI=1S/C9H10FN/c1-6-4-7-5-8(10)2-3-9(7)11-6/h2-3,5-6,11H,4H2,1H3
InChIKey
DATGDQQKEPRIPH-UHFFFAOYSA-N
Compound name
5-fluoro-2-methyl-2,3-dihydro-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

56
Patents

151.07973 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.087006 128.8
[M+Na]+ 174.068948 138.2
[M-H]- 150.072454 129.7
[M+NH4]+ 169.113553 151.3
[M+K]+ 190.042888 134.4
[M+H-H2O]+ 134.076990 122.5
[M+HCOO]- 196.077931 148.8
[M+CH3COO]- 210.093581 142.4
[M+Na-2H]- 172.054396 134.3
[M]+ 151.07918142 125.2
[M]- 151.08027858 125.2
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