CID 55285033

2-amino-3-cyclopropylbutanoic acid hydrochloride

Structural Information

Molecular Formula
C7H13NO2
SMILES
CC(C1CC1)C(C(=O)O)N
InChI
InChI=1S/C7H13NO2/c1-4(5-2-3-5)6(8)7(9)10/h4-6H,2-3,8H2,1H3,(H,9,10)
InChIKey
NAKLBXVLJBZSIP-UHFFFAOYSA-N
Compound name
2-amino-3-cyclopropylbutanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

11
Patents

143.09464 Da
Monoisotopic Mass

-1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.10192 128.4
[M+Na]+ 166.08386 135.6
[M-H]- 142.08736 131.3
[M+NH4]+ 161.12846 143.7
[M+K]+ 182.05780 133.7
[M+H-H2O]+ 126.09190 122.9
[M+HCOO]- 188.09284 149.0
[M+CH3COO]- 202.10849 179.3
[M+Na-2H]- 164.06931 130.9
[M]+ 143.09409 128.1
[M]- 143.09519 128.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe