CID 59254665

1-(3-fluorophenyl)-2,2-dimethylpropan-1-amine

Structural Information

Molecular Formula
C11H16FN
SMILES
CC(C)(C)C(C1=CC(=CC=C1)F)N
InChI
InChI=1S/C11H16FN/c1-11(2,3)10(13)8-5-4-6-9(12)7-8/h4-7,10H,13H2,1-3H3
InChIKey
ONHZOAAJDYSRRQ-UHFFFAOYSA-N
Compound name
1-(3-fluorophenyl)-2,2-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

181.12668 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.13396 140.3
[M+Na]+ 204.11590 147.3
[M-H]- 180.11940 142.4
[M+NH4]+ 199.16050 160.2
[M+K]+ 220.08984 145.0
[M+H-H2O]+ 164.12394 134.1
[M+HCOO]- 226.12488 161.0
[M+CH3COO]- 240.14053 185.9
[M+Na-2H]- 202.10135 144.8
[M]+ 181.12613 137.2
[M]- 181.12723 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

patents stripe