CID 32552

(+-)-endo-n,n-bis(p-fluorobenzyl)-2-bornanamine hydrobromide

Structural Information

Molecular Formula
C24H29F2N
SMILES
CC1(C2CCC1(C(C2)N(CC3=CC=C(C=C3)F)CC4=CC=C(C=C4)F)C)C
InChI
InChI=1S/C24H29F2N/c1-23(2)19-12-13-24(23,3)22(14-19)27(15-17-4-8-20(25)9-5-17)16-18-6-10-21(26)11-7-18/h4-11,19,22H,12-16H2,1-3H3
InChIKey
MEEFEABZPMXEMJ-UHFFFAOYSA-N
Compound name
N,N-bis[(4-fluorophenyl)methyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

369.2268 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.23408 190.6
[M+Na]+ 392.21602 198.0
[M-H]- 368.21952 198.6
[M+NH4]+ 387.26062 212.5
[M+K]+ 408.18996 191.6
[M+H-H2O]+ 352.22406 181.4
[M+HCOO]- 414.22500 209.2
[M+CH3COO]- 428.24065 201.0
[M+Na-2H]- 390.20147 188.7
[M]+ 369.22625 189.2
[M]- 369.22735 189.2
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

No patent data available for this compound.