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]+ 277.191056 167.2
[M+Na]+ 299.172998 174.7
[M-H]- 275.176504 171.6
[M+NH4]+ 294.217603 184.0
[M+K]+ 315.146938 172.2
[M+H-H2O]+ 259.181040 160.8
[M+HCOO]- 321.181981 190.2
[M+CH3COO]- 335.197631 211.3
[M+Na-2H]- 297.158446 166.3
[M]+ 276.18323142 170.1
[M]- 276.18432858 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.