CID 62197052

[1-(2,4-difluorophenyl)-3-methoxypropan-2-yl](methyl)amine hydrochloride

Structural Information

Molecular Formula
C11H15F2NO
SMILES
CNC(CC1=C(C=C(C=C1)F)F)COC
InChI
InChI=1S/C11H15F2NO/c1-14-10(7-15-2)5-8-3-4-9(12)6-11(8)13/h3-4,6,10,14H,5,7H2,1-2H3
InChIKey
VOPKICKDORISFL-UHFFFAOYSA-N
Compound name
1-(2,4-difluorophenyl)-3-methoxy-N-methylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.11217 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.11945 145.7
[M+Na]+ 238.10139 153.1
[M-H]- 214.10489 146.8
[M+NH4]+ 233.14599 164.4
[M+K]+ 254.07533 150.7
[M+H-H2O]+ 198.10943 137.7
[M+HCOO]- 260.11037 167.7
[M+CH3COO]- 274.12602 192.8
[M+Na-2H]- 236.08684 149.2
[M]+ 215.11162 144.8
[M]- 215.11272 144.8
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.