CID 28819459

N-[(2-aminophenyl)methyl]-n-methylacetamide

Structural Information

Molecular Formula
C10H14N2O
SMILES
CC(=O)N(C)CC1=CC=CC=C1N
InChI
InChI=1S/C10H14N2O/c1-8(13)12(2)7-9-5-3-4-6-10(9)11/h3-6H,7,11H2,1-2H3
InChIKey
UTPLQUMGUWFCML-UHFFFAOYSA-N
Compound name
N-[(2-aminophenyl)methyl]-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

178.11061 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.11789 139.6
[M+Na]+ 201.09983 146.1
[M-H]- 177.10333 144.4
[M+NH4]+ 196.14443 159.7
[M+K]+ 217.07377 145.3
[M+H-H2O]+ 161.10787 133.1
[M+HCOO]- 223.10881 165.2
[M+CH3COO]- 237.12446 189.4
[M+Na-2H]- 199.08528 144.0
[M]+ 178.11006 139.0
[M]- 178.11116 139.0
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

No patent data available for this compound.