CID 15208635

3-bromo-2-methoxy-2-methylpropan-1-amine hydrochloride

Structural Information

Molecular Formula
C5H12BrNO
SMILES
CC(CN)(CBr)OC
InChI
InChI=1S/C5H12BrNO/c1-5(3-6,4-7)8-2/h3-4,7H2,1-2H3
InChIKey
MYENXTSKXFCMFL-UHFFFAOYSA-N
Compound name
3-bromo-2-methoxy-2-methylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.01022 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.01750 133.6
[M+Na]+ 203.99944 144.1
[M-H]- 180.00294 136.3
[M+NH4]+ 199.04404 156.6
[M+K]+ 219.97338 134.2
[M+H-H2O]+ 164.00748 134.0
[M+HCOO]- 226.00842 154.1
[M+CH3COO]- 240.02407 181.2
[M+Na-2H]- 201.98489 141.6
[M]+ 181.00967 151.8
[M]- 181.01077 151.8
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.