CID 29534

P-acetanisidide, 2-iodo-

Structural Information

Molecular Formula
C9H10INO2
SMILES
COC1=CC=C(C=C1)NC(=O)CI
InChI
InChI=1S/C9H10INO2/c1-13-8-4-2-7(3-5-8)11-9(12)6-10/h2-5H,6H2,1H3,(H,11,12)
InChIKey
HBDHZJFUSFWUEF-UHFFFAOYSA-N
Compound name
2-iodo-N-(4-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 151.4
[M+Na]+ 313.96484 151.5
[M-H]- 289.96834 148.1
[M+NH4]+ 309.00944 166.0
[M+K]+ 329.93878 155.9
[M+H-H2O]+ 273.97288 141.5
[M+HCOO]- 335.97382 171.0
[M+CH3COO]- 349.98947 191.9
[M+Na-2H]- 311.95029 144.8
[M]+ 290.97507 149.7
[M]- 290.97617 149.7
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

patents stripe