CID 52908304

N-(4-iodo-3-methoxyphenyl)acetamide

Structural Information

Molecular Formula
C9H10INO2
SMILES
CC(=O)NC1=CC(=C(C=C1)I)OC
InChI
InChI=1S/C9H10INO2/c1-6(12)11-7-3-4-8(10)9(5-7)13-2/h3-5H,1-2H3,(H,11,12)
InChIKey
YFVRLMPECJRYMS-UHFFFAOYSA-N
Compound name
N-(4-iodo-3-methoxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.97562 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.98290 150.2
[M+Na]+ 313.96484 151.2
[M-H]- 289.96834 147.3
[M+NH4]+ 309.00944 165.1
[M+K]+ 329.93878 155.6
[M+H-H2O]+ 273.97288 140.6
[M+HCOO]- 335.97382 169.8
[M+CH3COO]- 349.98947 193.0
[M+Na-2H]- 311.95029 143.0
[M]+ 290.97507 148.9
[M]- 290.97617 148.9
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.