CID 81720

N-(3-acetyl-4-hydroxyphenyl)acetamide

Structural Information

Molecular Formula
C10H11NO3
SMILES
CC(=O)C1=C(C=CC(=C1)NC(=O)C)O
InChI
InChI=1S/C10H11NO3/c1-6(12)9-5-8(11-7(2)13)3-4-10(9)14/h3-5,14H,1-2H3,(H,11,13)
InChIKey
DIQSYMRVTOVKQT-UHFFFAOYSA-N
Compound name
N-(3-acetyl-4-hydroxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

134
Patents

193.0739 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.08118 139.8
[M+Na]+ 216.06312 147.3
[M-H]- 192.06662 142.7
[M+NH4]+ 211.10772 158.5
[M+K]+ 232.03706 145.7
[M+H-H2O]+ 176.07116 134.1
[M+HCOO]- 238.07210 162.6
[M+CH3COO]- 252.08775 184.5
[M+Na-2H]- 214.04857 143.4
[M]+ 193.07335 139.8
[M]- 193.07445 139.8
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

patents stripe