CID 113490

N,n'-(3-methylbutylidene)bismethacrylamide

Structural Information

Molecular Formula
C13H22N2O2
SMILES
CC(C)CC(NC(=O)C(=C)C)NC(=O)C(=C)C
InChI
InChI=1S/C13H22N2O2/c1-8(2)7-11(14-12(16)9(3)4)15-13(17)10(5)6/h8,11H,3,5,7H2,1-2,4,6H3,(H,14,16)(H,15,17)
InChIKey
WMCQRSRSFMERMW-UHFFFAOYSA-N
Compound name
2-methyl-N-[3-methyl-1-(2-methylprop-2-enoylamino)butyl]prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

238.16812 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.175396 161.4
[M+Na]+ 261.157338 164.0
[M-H]- 237.160844 161.0
[M+NH4]+ 256.201943 178.0
[M+K]+ 277.131278 163.5
[M+H-H2O]+ 221.165380 155.4
[M+HCOO]- 283.166321 180.3
[M+CH3COO]- 297.181971 202.5
[M+Na-2H]- 259.142786 157.7
[M]+ 238.16757142 159.7
[M]- 238.16866858 159.7
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