CID 155858629

Methyl (2r,3r)-2-amino-3-bromobutanoate hydrochloride

Structural Information

Molecular Formula
C5H10BrNO2
SMILES
C[C@H]([C@@H](C(=O)OC)N)Br
InChI
InChI=1S/C5H10BrNO2/c1-3(6)4(7)5(8)9-2/h3-4H,7H2,1-2H3/t3-,4+/m1/s1
InChIKey
NLDVVTQYHAVPTD-DMTCNVIQSA-N
Compound name
methyl (2R,3R)-2-amino-3-bromobutanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.98949 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.99677 133.0
[M+Na]+ 217.97871 132.5
[M+NH4]+ 213.02331 136.5
[M+K]+ 233.95265 135.4
[M-H]- 193.98221 130.6
[M+Na-2H]- 215.96416 132.8
[M]+ 194.98894 130.7
[M]- 194.99004 130.7
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.