CID 60987387

2-[4-(difluoromethoxy)phenyl]-2-methylpropan-1-amine

Structural Information

Molecular Formula
C11H15F2NO
SMILES
CC(C)(CN)C1=CC=C(C=C1)OC(F)F
InChI
InChI=1S/C11H15F2NO/c1-11(2,7-14)8-3-5-9(6-4-8)15-10(12)13/h3-6,10H,7,14H2,1-2H3
InChIKey
JJZVGPJTBWDCFI-UHFFFAOYSA-N
Compound name
2-[4-(difluoromethoxy)phenyl]-2-methylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.11217 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.119446 146.4
[M+Na]+ 238.101388 153.3
[M-H]- 214.104894 146.9
[M+NH4]+ 233.145993 164.6
[M+K]+ 254.075328 151.0
[M+H-H2O]+ 198.109430 138.9
[M+HCOO]- 260.110371 166.2
[M+CH3COO]- 274.126021 191.4
[M+Na-2H]- 236.086836 150.3
[M]+ 215.11162142 143.6
[M]- 215.11271858 143.6
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.