CID 250559

1,6-hexamethylenebisacrylamide

Structural Information

Molecular Formula
C12H20N2O2
SMILES
C=CC(=O)NCCCCCCNC(=O)C=C
InChI
InChI=1S/C12H20N2O2/c1-3-11(15)13-9-7-5-6-8-10-14-12(16)4-2/h3-4H,1-2,5-10H2,(H,13,15)(H,14,16)
InChIKey
YQCFXPARMSSRRK-UHFFFAOYSA-N
Compound name
N-[6-(prop-2-enoylamino)hexyl]prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

8521
Patents

224.15248 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.15976 155.8
[M+Na]+ 247.14170 159.6
[M-H]- 223.14520 155.1
[M+NH4]+ 242.18630 173.2
[M+K]+ 263.11564 157.2
[M+H-H2O]+ 207.14974 149.4
[M+HCOO]- 269.15068 179.0
[M+CH3COO]- 283.16633 195.8
[M+Na-2H]- 245.12715 157.6
[M]+ 224.15193 156.3
[M]- 224.15303 156.3
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.