CID 65668269

1-(2,4-difluorophenyl)-3-ethoxypropan-2-amine

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.11217 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.119446 146.3
[M+Na]+ 238.101388 153.7
[M-H]- 214.104894 146.8
[M+NH4]+ 233.145993 164.7
[M+K]+ 254.075328 150.9
[M+H-H2O]+ 198.109430 138.3
[M+HCOO]- 260.110371 167.7
[M+CH3COO]- 274.126021 192.1
[M+Na-2H]- 236.086836 148.7
[M]+ 215.11162142 144.4
[M]- 215.11271858 144.4
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.