CID 25567

N-(2-bromopropyl)-n-ethyl-9-fluorenamine hydrobromide

Structural Information

Molecular Formula
C18H20BrN
SMILES
CCN(CC(C)Br)C1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C18H20BrN/c1-3-20(12-13(2)19)18-16-10-6-4-8-14(16)15-9-5-7-11-17(15)18/h4-11,13,18H,3,12H2,1-2H3
InChIKey
HDVDZKXWJPAWSU-UHFFFAOYSA-N
Compound name
N-(2-bromopropyl)-N-ethyl-9H-fluoren-9-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.0779 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.08518 177.4
[M+Na]+ 352.06712 187.2
[M-H]- 328.07062 186.1
[M+NH4]+ 347.11172 199.2
[M+K]+ 368.04106 175.5
[M+H-H2O]+ 312.07516 176.4
[M+HCOO]- 374.07610 197.2
[M+CH3COO]- 388.09175 190.6
[M+Na-2H]- 350.05257 181.4
[M]+ 329.07735 197.5
[M]- 329.07845 197.5
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.