CID 32550

(+-)-endo-n-(3-(p-fluorophenyl)propyl)-2-bornanamine hydrobromide

Structural Information

Molecular Formula
C19H28FN
SMILES
CC1(C2CCC1(C(C2)NCCCC3=CC=C(C=C3)F)C)C
InChI
InChI=1S/C19H28FN/c1-18(2)15-10-11-19(18,3)17(13-15)21-12-4-5-14-6-8-16(20)9-7-14/h6-9,15,17,21H,4-5,10-13H2,1-3H3
InChIKey
WWXGTFSSJYLKRT-UHFFFAOYSA-N
Compound name
N-[3-(4-fluorophenyl)propyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.22058 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.22786 170.3
[M+Na]+ 312.20980 177.5
[M-H]- 288.21330 175.0
[M+NH4]+ 307.25440 195.2
[M+K]+ 328.18374 171.8
[M+H-H2O]+ 272.21784 164.1
[M+HCOO]- 334.21878 189.9
[M+CH3COO]- 348.23443 206.9
[M+Na-2H]- 310.19525 171.6
[M]+ 289.22003 169.2
[M]- 289.22113 169.2
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.