CID 27382

15560-61-9

Structural Information

Molecular Formula
C13H19NO4
SMILES
CCCCOC1=C(C=C(C=C1)CC(=O)NO)OC
InChI
InChI=1S/C13H19NO4/c1-3-4-7-18-11-6-5-10(8-12(11)17-2)9-13(15)14-16/h5-6,8,16H,3-4,7,9H2,1-2H3,(H,14,15)
InChIKey
QRJCDIVJPRWSMH-UHFFFAOYSA-N
Compound name
2-(4-butoxy-3-methoxyphenyl)-N-hydroxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.13141 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.13869 157.6
[M+Na]+ 276.12063 163.6
[M-H]- 252.12413 159.7
[M+NH4]+ 271.16523 173.9
[M+K]+ 292.09457 161.9
[M+H-H2O]+ 236.12867 150.7
[M+HCOO]- 298.12961 180.4
[M+CH3COO]- 312.14526 195.6
[M+Na-2H]- 274.10608 160.8
[M]+ 253.13086 161.4
[M]- 253.13196 161.4
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.