CID 121030

Fc 378

Structural Information

Molecular Formula
C12H18N2O2
SMILES
CCNC(=O)CNC1=CC=C(C=C1)OCC
InChI
InChI=1S/C12H18N2O2/c1-3-13-12(15)9-14-10-5-7-11(8-6-10)16-4-2/h5-8,14H,3-4,9H2,1-2H3,(H,13,15)
InChIKey
AIIBTXLYHGZQGY-UHFFFAOYSA-N
Compound name
2-(4-ethoxyanilino)-N-ethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.13683 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.14411 151.1
[M+Na]+ 245.12605 156.4
[M-H]- 221.12955 154.4
[M+NH4]+ 240.17065 168.8
[M+K]+ 261.09999 154.6
[M+H-H2O]+ 205.13409 144.0
[M+HCOO]- 267.13503 176.3
[M+CH3COO]- 281.15068 194.7
[M+Na-2H]- 243.11150 156.3
[M]+ 222.13628 152.4
[M]- 222.13738 152.4
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.