CID 82607023

1-(4-fluoro-3-methoxyphenyl)-2-methylpropan-2-amine

Structural Information

Molecular Formula
C11H16FNO
SMILES
CC(C)(CC1=CC(=C(C=C1)F)OC)N
InChI
InChI=1S/C11H16FNO/c1-11(2,13)7-8-4-5-9(12)10(6-8)14-3/h4-6H,7,13H2,1-3H3
InChIKey
YCTJAZLTWRVMMG-UHFFFAOYSA-N
Compound name
1-(4-fluoro-3-methoxyphenyl)-2-methylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.1216 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.12888 143.1
[M+Na]+ 220.11082 151.2
[M-H]- 196.11432 145.4
[M+NH4]+ 215.15542 162.6
[M+K]+ 236.08476 148.9
[M+H-H2O]+ 180.11886 136.8
[M+HCOO]- 242.11980 165.0
[M+CH3COO]- 256.13545 188.9
[M+Na-2H]- 218.09627 148.2
[M]+ 197.12105 142.6
[M]- 197.12215 142.6
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.