CID 21149775

94030-95-2

Structural Information

Molecular Formula
C17H19FN2O2
SMILES
CN(CC(CNC(=O)C1=CC=CC=C1)O)C2=CC(=CC=C2)F
InChI
InChI=1S/C17H19FN2O2/c1-20(15-9-5-8-14(18)10-15)12-16(21)11-19-17(22)13-6-3-2-4-7-13/h2-10,16,21H,11-12H2,1H3,(H,19,22)
InChIKey
HNSPHBVGTCNGOE-UHFFFAOYSA-N
Compound name
N-[3-(3-fluoro-N-methylanilino)-2-hydroxypropyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.14307 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.150346 170.7
[M+Na]+ 325.132288 174.5
[M-H]- 301.135794 175.4
[M+NH4]+ 320.176893 184.3
[M+K]+ 341.106228 171.5
[M+H-H2O]+ 285.140330 161.1
[M+HCOO]- 347.141271 192.6
[M+CH3COO]- 361.156921 210.0
[M+Na-2H]- 323.117736 172.8
[M]+ 302.14252142 168.8
[M]- 302.14361858 168.8
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.