CID 88811

21165-54-8

Structural Information

Molecular Formula
C17H17F2N
SMILES
CN(C)CC=C(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F
InChI
InChI=1S/C17H17F2N/c1-20(2)12-11-17(13-3-7-15(18)8-4-13)14-5-9-16(19)10-6-14/h3-11H,12H2,1-2H3
InChIKey
DHZIEKGZDHVBSK-UHFFFAOYSA-N
Compound name
3,3-bis(4-fluorophenyl)-N,N-dimethylprop-2-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.1329 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.14018 162.6
[M+Na]+ 296.12212 169.3
[M-H]- 272.12562 167.8
[M+NH4]+ 291.16672 179.1
[M+K]+ 312.09606 165.0
[M+H-H2O]+ 256.13016 152.8
[M+HCOO]- 318.13110 184.5
[M+CH3COO]- 332.14675 206.4
[M+Na-2H]- 294.10757 164.7
[M]+ 273.13235 160.5
[M]- 273.13345 160.5
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.