CID 20992

1,6-bismaleimidohexane

Structural Information

Molecular Formula
C14H16N2O4
SMILES
C1=CC(=O)N(C1=O)CCCCCCN2C(=O)C=CC2=O
InChI
InChI=1S/C14H16N2O4/c17-11-5-6-12(18)15(11)9-3-1-2-4-10-16-13(19)7-8-14(16)20/h5-8H,1-4,9-10H2
InChIKey
PYVHLZLQVWXBDZ-UHFFFAOYSA-N
Compound name
1-[6-(2,5-dioxopyrrol-1-yl)hexyl]pyrrole-2,5-dione
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

46
References

5050
Patents

276.111 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.11828 161.4
[M+Na]+ 299.10022 169.9
[M-H]- 275.10372 165.8
[M+NH4]+ 294.14482 178.4
[M+K]+ 315.07416 166.7
[M+H-H2O]+ 259.10826 154.0
[M+HCOO]- 321.10920 183.3
[M+CH3COO]- 335.12485 197.9
[M+Na-2H]- 297.08567 159.9
[M]+ 276.11045 164.6
[M]- 276.11155 164.6
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