CID 139594143

Dtxsid701028604

Structural Information

Molecular Formula
C13H19NO3
SMILES
CC1=C(C(=CC=C1)C)N(CCOC)C(=O)CO
InChI
InChI=1S/C13H19NO3/c1-10-5-4-6-11(2)13(10)14(7-8-17-3)12(16)9-15/h4-6,15H,7-9H2,1-3H3
InChIKey
AGEOQFQAZYZFME-UHFFFAOYSA-N
Compound name
N-(2,6-dimethylphenyl)-2-hydroxy-N-(2-methoxyethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

0
Patents

237.13649 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.14377 154.7
[M+Na]+ 260.12571 161.0
[M-H]- 236.12921 158.4
[M+NH4]+ 255.17031 172.4
[M+K]+ 276.09965 160.2
[M+H-H2O]+ 220.13375 148.0
[M+HCOO]- 282.13469 177.8
[M+CH3COO]- 296.15034 196.9
[M+Na-2H]- 258.11116 157.1
[M]+ 237.13594 158.3
[M]- 237.13704 158.3
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

No patent data available for this compound.