CID 6278565

3-(cyclopropylamino)acrylic acid

Structural Information

Molecular Formula
C6H9NO2
SMILES
C1CC1N/C=C/C(=O)O
InChI
InChI=1S/C6H9NO2/c8-6(9)3-4-7-5-1-2-5/h3-5,7H,1-2H2,(H,8,9)/b4-3+
InChIKey
RMBZGFRPRFOSCD-ONEGZZNKSA-N
Compound name
(E)-3-(cyclopropylamino)prop-2-enoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

127.06333 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.07061 126.1
[M+Na]+ 150.05255 136.3
[M+NH4]+ 145.09715 133.9
[M+K]+ 166.02649 133.4
[M-H]- 126.05605 133.0
[M+Na-2H]- 148.03800 132.7
[M]+ 127.06278 130.2
[M]- 127.06388 130.2
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