CID 15659604

2-(1-aminocyclopropyl)acetic acid hydrochloride

Structural Information

Molecular Formula
C5H9NO2
SMILES
C1CC1(CC(=O)O)N
InChI
InChI=1S/C5H9NO2/c6-5(1-2-5)3-4(7)8/h1-3,6H2,(H,7,8)
InChIKey
MXXPCZIAOHMCKI-UHFFFAOYSA-N
Compound name
2-(1-aminocyclopropyl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

77
Patents

115.06333 Da
Monoisotopic Mass

-2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.07061 121.4
[M+Na]+ 138.05255 130.5
[M-H]- 114.05605 124.8
[M+NH4]+ 133.09715 139.8
[M+K]+ 154.02649 129.2
[M+H-H2O]+ 98.060590 117.4
[M+HCOO]- 160.06153 144.1
[M+CH3COO]- 174.07718 171.4
[M+Na-2H]- 136.03800 128.3
[M]+ 115.06278 122.0
[M]- 115.06388 122.0
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

patents stripe