CID 207681

Benzamide, 2-(allyloxy)-5-amino-n-ethyl-

Structural Information

Molecular Formula
C12H16N2O2
SMILES
CCNC(=O)C1=C(C=CC(=C1)N)OCC=C
InChI
InChI=1S/C12H16N2O2/c1-3-7-16-11-6-5-9(13)8-10(11)12(15)14-4-2/h3,5-6,8H,1,4,7,13H2,2H3,(H,14,15)
InChIKey
BIGXWVGRFWHSCI-UHFFFAOYSA-N
Compound name
5-amino-N-ethyl-2-prop-2-enoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.12119 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.128466 150.2
[M+Na]+ 243.110408 156.7
[M-H]- 219.113914 153.4
[M+NH4]+ 238.155013 168.0
[M+K]+ 259.084348 154.0
[M+H-H2O]+ 203.118450 143.4
[M+HCOO]- 265.119391 175.0
[M+CH3COO]- 279.135041 194.5
[M+Na-2H]- 241.095856 153.6
[M]+ 220.12064142 150.1
[M]- 220.12173858 150.1
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.