CID 203146

Salicylic acid, 4-(2-(diethylamino)acetamido)-, propyl ester, hydrochloride

Structural Information

Molecular Formula
C16H24N2O4
SMILES
CCCOC(=O)C1=C(C=C(C=C1)NC(=O)CN(CC)CC)O
InChI
InChI=1S/C16H24N2O4/c1-4-9-22-16(21)13-8-7-12(10-14(13)19)17-15(20)11-18(5-2)6-3/h7-8,10,19H,4-6,9,11H2,1-3H3,(H,17,20)
InChIKey
KJYIQJHZLYTWOW-UHFFFAOYSA-N
Compound name
propyl 4-[[2-(diethylamino)acetyl]amino]-2-hydroxybenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.1736 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.180876 174.5
[M+Na]+ 331.162818 178.6
[M-H]- 307.166324 177.6
[M+NH4]+ 326.207423 188.7
[M+K]+ 347.136758 177.7
[M+H-H2O]+ 291.170860 166.7
[M+HCOO]- 353.171801 197.0
[M+CH3COO]- 367.187451 212.6
[M+Na-2H]- 329.148266 174.6
[M]+ 308.17305142 178.5
[M]- 308.17414858 178.5
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.