CID 21504680

2-(1-acetamidocyclopropyl)acetic acid

Structural Information

Molecular Formula
C7H11NO3
SMILES
CC(=O)NC1(CC1)CC(=O)O
InChI
InChI=1S/C7H11NO3/c1-5(9)8-7(2-3-7)4-6(10)11/h2-4H2,1H3,(H,8,9)(H,10,11)
InChIKey
SBYCWQPNKUMQSR-UHFFFAOYSA-N
Compound name
2-(1-acetamidocyclopropyl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.0739 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.08118 135.2
[M+Na]+ 180.06312 144.8
[M+NH4]+ 175.10772 143.6
[M+K]+ 196.03706 141.2
[M-H]- 156.06662 141.6
[M+Na-2H]- 178.04857 142.3
[M]+ 157.07335 139.3
[M]- 157.07445 139.3
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.