CID 117008

Einecs 275-180-9

Structural Information

Molecular Formula
C13H20N2O3
SMILES
CCNC1=C(C=CC(=C1)NC(=O)C)OCCOC
InChI
InChI=1S/C13H20N2O3/c1-4-14-12-9-11(15-10(2)16)5-6-13(12)18-8-7-17-3/h5-6,9,14H,4,7-8H2,1-3H3,(H,15,16)
InChIKey
YCBDVCSNGODBQA-UHFFFAOYSA-N
Compound name
N-[3-(ethylamino)-4-(2-methoxyethoxy)phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.1474 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.15468 158.3
[M+Na]+ 275.13662 163.9
[M-H]- 251.14012 161.8
[M+NH4]+ 270.18122 175.1
[M+K]+ 291.11056 162.6
[M+H-H2O]+ 235.14466 150.9
[M+HCOO]- 297.14560 183.4
[M+CH3COO]- 311.16125 201.1
[M+Na-2H]- 273.12207 162.3
[M]+ 252.14685 161.8
[M]- 252.14795 161.8
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

patents stripe