CID 55302042

2742623-38-5

Structural Information

Molecular Formula
C5H10ClNO2
SMILES
C(C[C@@H](C(=O)O)N)CCl
InChI
InChI=1S/C5H10ClNO2/c6-3-1-2-4(7)5(8)9/h4H,1-3,7H2,(H,8,9)/t4-/m0/s1
InChIKey
GVDZCTQNNXIPAQ-BYPYZUCNSA-N
Compound name
(2S)-2-amino-5-chloropentanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

151.04001 Da
Monoisotopic Mass

-2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.04729 130.2
[M+Na]+ 174.02923 137.1
[M-H]- 150.03273 128.6
[M+NH4]+ 169.07383 150.8
[M+K]+ 190.00317 134.8
[M+H-H2O]+ 134.03727 126.7
[M+HCOO]- 196.03821 147.4
[M+CH3COO]- 210.05386 174.3
[M+Na-2H]- 172.01468 133.4
[M]+ 151.03946 130.0
[M]- 151.04056 130.0
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.