CID 278680

N,n'-(2,3,5,6-tetramethyl-1,4-xylylene)bisacetamide

Structural Information

Molecular Formula
C16H24N2O2
SMILES
CC1=C(C(=C(C(=C1CNC(=O)C)C)C)CNC(=O)C)C
InChI
InChI=1S/C16H24N2O2/c1-9-10(2)16(8-18-14(6)20)12(4)11(3)15(9)7-17-13(5)19/h7-8H2,1-6H3,(H,17,19)(H,18,20)
InChIKey
ODWKBJHZGDBMPF-UHFFFAOYSA-N
Compound name
N-[[4-(acetamidomethyl)-2,3,5,6-tetramethylphenyl]methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.18378 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.19106 167.2
[M+Na]+ 299.17300 174.7
[M-H]- 275.17650 171.6
[M+NH4]+ 294.21760 184.0
[M+K]+ 315.14694 172.2
[M+H-H2O]+ 259.18104 160.8
[M+HCOO]- 321.18198 190.2
[M+CH3COO]- 335.19763 211.3
[M+Na-2H]- 297.15845 166.3
[M]+ 276.18323 170.1
[M]- 276.18433 170.1
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.