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

8675
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

literature stripe

Patent stripe

patents stripe