CID 65667527

[(4,6-difluoro-1-benzofuran-3-yl)methyl](methyl)amine hydrochloride

Structural Information

Molecular Formula
C10H9F2NO
SMILES
CNCC1=COC2=C1C(=CC(=C2)F)F
InChI
InChI=1S/C10H9F2NO/c1-13-4-6-5-14-9-3-7(11)2-8(12)10(6)9/h2-3,5,13H,4H2,1H3
InChIKey
IHWZYKBXZRVFJH-UHFFFAOYSA-N
Compound name
1-(4,6-difluoro-1-benzofuran-3-yl)-N-methylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.06522 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.07250 135.6
[M+Na]+ 220.05444 147.2
[M-H]- 196.05794 139.5
[M+NH4]+ 215.09904 157.1
[M+K]+ 236.02838 144.6
[M+H-H2O]+ 180.06248 128.7
[M+HCOO]- 242.06342 160.2
[M+CH3COO]- 256.07907 187.1
[M+Na-2H]- 218.03989 143.0
[M]+ 197.06467 137.2
[M]- 197.06577 137.2
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

No patent data available for this compound.