CID 268126

3-amino-n,n-diethylbenzamide

Structural Information

Molecular Formula
C11H16N2O
SMILES
CCN(CC)C(=O)C1=CC(=CC=C1)N
InChI
InChI=1S/C11H16N2O/c1-3-13(4-2)11(14)9-6-5-7-10(12)8-9/h5-8H,3-4,12H2,1-2H3
InChIKey
PECCRTHITMTOJM-UHFFFAOYSA-N
Compound name
3-amino-N,N-diethylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

192.12627 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.133546 144.3
[M+Na]+ 215.115488 150.3
[M-H]- 191.118994 148.9
[M+NH4]+ 210.160093 163.8
[M+K]+ 231.089428 149.3
[M+H-H2O]+ 175.123530 137.6
[M+HCOO]- 237.124471 169.6
[M+CH3COO]- 251.140121 192.4
[M+Na-2H]- 213.100936 148.2
[M]+ 192.12572142 144.1
[M]- 192.12681858 144.1
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