CID 20117962

3-amino-n-benzyl-n-methylpropanamide hydrochloride

Structural Information

Molecular Formula
C11H16N2O
SMILES
CN(CC1=CC=CC=C1)C(=O)CCN
InChI
InChI=1S/C11H16N2O/c1-13(11(14)7-8-12)9-10-5-3-2-4-6-10/h2-6H,7-9,12H2,1H3
InChIKey
WCDCXEADXDPSLB-UHFFFAOYSA-N
Compound name
3-amino-N-benzyl-N-methylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.12627 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.133546 144.6
[M+Na]+ 215.115488 149.6
[M-H]- 191.118994 148.7
[M+NH4]+ 210.160093 163.7
[M+K]+ 231.089428 148.6
[M+H-H2O]+ 175.123530 137.6
[M+HCOO]- 237.124471 169.9
[M+CH3COO]- 251.140121 191.3
[M+Na-2H]- 213.100936 149.2
[M]+ 192.12572142 143.9
[M]- 192.12681858 143.9
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.