CID 415291

(3-bromopropyl)diethylamine hydrobromide

Structural Information

Molecular Formula
C7H16BrN
SMILES
CCN(CC)CCCBr
InChI
InChI=1S/C7H16BrN/c1-3-9(4-2)7-5-6-8/h3-7H2,1-2H3
InChIKey
UPASYJUQYLIDMN-UHFFFAOYSA-N
Compound name
3-bromo-N,N-diethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

193.04662 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.05390 137.6
[M+Na]+ 216.03584 138.8
[M+NH4]+ 211.08044 142.6
[M+K]+ 232.00978 138.4
[M-H]- 192.03934 137.3
[M+Na-2H]- 214.02129 139.3
[M]+ 193.04607 136.3
[M]- 193.04717 136.3
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