CID 20648786

2-(bromomethyl)-1-methylpiperidine hydrobromide

Structural Information

Molecular Formula
C7H14BrN
SMILES
CN1CCCCC1CBr
InChI
InChI=1S/C7H14BrN/c1-9-5-3-2-4-7(9)6-8/h7H,2-6H2,1H3
InChIKey
HCUCPVSXWXKPQD-UHFFFAOYSA-N
Compound name
2-(bromomethyl)-1-methylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

191.03096 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.03824 135.7
[M+Na]+ 214.02018 145.2
[M-H]- 190.02368 140.1
[M+NH4]+ 209.06478 157.7
[M+K]+ 229.99412 135.4
[M+H-H2O]+ 174.02822 135.9
[M+HCOO]- 236.02916 153.1
[M+CH3COO]- 250.04481 180.9
[M+Na-2H]- 212.00563 142.4
[M]+ 191.03041 150.4
[M]- 191.03151 150.4
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