CID 116354361

2413884-09-8

Structural Information

Molecular Formula
C8H16BrN
SMILES
CN(CCCBr)C1CCC1
InChI
InChI=1S/C8H16BrN/c1-10(7-3-6-9)8-4-2-5-8/h8H,2-7H2,1H3
InChIKey
GRFWTMQMHZZXIL-UHFFFAOYSA-N
Compound name
N-(3-bromopropyl)-N-methylcyclobutanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

205.04662 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.05390 139.9
[M+Na]+ 228.03584 137.3
[M+NH4]+ 223.08044 141.9
[M+K]+ 244.00978 138.7
[M-H]- 204.03934 138.5
[M+Na-2H]- 226.02129 140.2
[M]+ 205.04607 136.8
[M]- 205.04717 136.8
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

patents stripe