CID 155894570

2306268-94-8

Structural Information

Molecular Formula
C7H14BrN
SMILES
CC1(CCNCC1)CBr
InChI
InChI=1S/C7H14BrN/c1-7(6-8)2-4-9-5-3-7/h9H,2-6H2,1H3
InChIKey
GCVRELGIVUEAGF-UHFFFAOYSA-N
Compound name
4-(bromomethyl)-4-methylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.03096 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.03824 135.6
[M+Na]+ 214.02018 144.7
[M-H]- 190.02368 138.7
[M+NH4]+ 209.06478 158.5
[M+K]+ 229.99412 134.2
[M+H-H2O]+ 174.02822 136.7
[M+HCOO]- 236.02916 151.7
[M+CH3COO]- 250.04481 177.0
[M+Na-2H]- 212.00563 143.5
[M]+ 191.03041 148.6
[M]- 191.03151 148.6
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

No patent data available for this compound.