CID 56474

92700-21-5

Structural Information

Molecular Formula
C15H22N2O3
SMILES
CCCOC1=CC=CC=C1N(CC(=O)N(C)C)C(=O)C
InChI
InChI=1S/C15H22N2O3/c1-5-10-20-14-9-7-6-8-13(14)17(12(2)18)11-15(19)16(3)4/h6-9H,5,10-11H2,1-4H3
InChIKey
QRSUEMINGJQHFV-UHFFFAOYSA-N
Compound name
2-(N-acetyl-2-propoxyanilino)-N,N-dimethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.16306 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.17034 167.2
[M+Na]+ 301.15228 171.6
[M-H]- 277.15578 173.1
[M+NH4]+ 296.19688 183.9
[M+K]+ 317.12622 172.5
[M+H-H2O]+ 261.16032 159.3
[M+HCOO]- 323.16126 191.9
[M+CH3COO]- 337.17691 212.1
[M+Na-2H]- 299.13773 168.2
[M]+ 278.16251 172.2
[M]- 278.16361 172.2
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.