CID 64204353

855474-64-5

Structural Information

Molecular Formula
C7H16BrN
SMILES
CN(C)CCCCCBr
InChI
InChI=1S/C7H16BrN/c1-9(2)7-5-3-4-6-8/h3-7H2,1-2H3
InChIKey
ISRFVGGMMWIYBP-UHFFFAOYSA-N
Compound name
5-bromo-N,N-dimethylpentan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
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 138.4
[M+Na]+ 216.03584 148.0
[M-H]- 192.03934 142.4
[M+NH4]+ 211.08044 161.8
[M+K]+ 232.00978 138.7
[M+H-H2O]+ 176.04388 138.1
[M+HCOO]- 238.04482 160.6
[M+CH3COO]- 252.06047 188.9
[M+Na-2H]- 214.02129 145.3
[M]+ 193.04607 158.6
[M]- 193.04717 158.6
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