CID 3666753

2-amino-2-phenylpropanamide

Structural Information

Molecular Formula
C9H12N2O
SMILES
CC(C1=CC=CC=C1)(C(=O)N)N
InChI
InChI=1S/C9H12N2O/c1-9(11,8(10)12)7-5-3-2-4-6-7/h2-6H,11H2,1H3,(H2,10,12)
InChIKey
HGKUPDZBTAQFGJ-UHFFFAOYSA-N
Compound name
2-amino-2-phenylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

177
Patents

164.09496 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.10224 135.0
[M+Na]+ 187.08418 141.1
[M-H]- 163.08768 137.7
[M+NH4]+ 182.12878 154.3
[M+K]+ 203.05812 139.2
[M+H-H2O]+ 147.09222 129.2
[M+HCOO]- 209.09316 158.2
[M+CH3COO]- 223.10881 182.1
[M+Na-2H]- 185.06963 141.0
[M]+ 164.09441 130.9
[M]- 164.09551 130.9
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