CID 61287527

(3-bromopropyl)(methyl)(propan-2-yl)amine hydrobromide

Structural Information

Molecular Formula
C7H16BrN
SMILES
CC(C)N(C)CCCBr
InChI
InChI=1S/C7H16BrN/c1-7(2)9(3)6-4-5-8/h7H,4-6H2,1-3H3
InChIKey
SZLSIHUQRKFHRV-UHFFFAOYSA-N
Compound name
3-bromo-N-methyl-N-propan-2-ylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.04662 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.053896 139.2
[M+Na]+ 216.035838 148.6
[M-H]- 192.039344 143.3
[M+NH4]+ 211.080443 162.6
[M+K]+ 232.009778 139.7
[M+H-H2O]+ 176.043880 138.9
[M+HCOO]- 238.044821 160.5
[M+CH3COO]- 252.060471 189.6
[M+Na-2H]- 214.021286 144.9
[M]+ 193.04607142 158.8
[M]- 193.04716858 158.8
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

No patent data available for this compound.