CID 3811580

2-amino-2-methyl-3-phenylpropanamide

Structural Information

Molecular Formula
C10H14N2O
SMILES
CC(CC1=CC=CC=C1)(C(=O)N)N
InChI
InChI=1S/C10H14N2O/c1-10(12,9(11)13)7-8-5-3-2-4-6-8/h2-6H,7,12H2,1H3,(H2,11,13)
InChIKey
LEBDCRNSLNAHHD-UHFFFAOYSA-N
Compound name
2-amino-2-methyl-3-phenylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

178.11061 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.11789 139.6
[M+Na]+ 201.09983 145.3
[M-H]- 177.10333 142.1
[M+NH4]+ 196.14443 158.4
[M+K]+ 217.07377 143.1
[M+H-H2O]+ 161.10787 133.6
[M+HCOO]- 223.10881 162.4
[M+CH3COO]- 237.12446 185.1
[M+Na-2H]- 199.08528 145.1
[M]+ 178.11006 135.9
[M]- 178.11116 135.9
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