CID 2724304

4-maleimido-tempo

Structural Information

Molecular Formula
C13H19N2O3
SMILES
CC1(CC(CC(N1[O])(C)C)N2C(=O)C=CC2=O)C
InChI
InChI=1S/C13H19N2O3/c1-12(2)7-9(8-13(3,4)15(12)18)14-10(16)5-6-11(14)17/h5-6,9H,7-8H2,1-4H3
InChIKey
CMNDHIFMYRPBGH-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

87
References

8
Patents

251.13957 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.14685 151.9
[M+Na]+ 274.12879 161.7
[M-H]- 250.13229 156.7
[M+NH4]+ 269.17339 172.8
[M+K]+ 290.10273 160.0
[M+H-H2O]+ 234.13683 146.3
[M+HCOO]- 296.13777 170.1
[M+CH3COO]- 310.15342 195.3
[M+Na-2H]- 272.11424 153.8
[M]+ 251.13902 152.5
[M]- 251.14012 152.5
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