CID 6442613

(e)-dec-2-enedioic acid

Structural Information

Molecular Formula
C10H16O4
SMILES
C(CCCC(=O)O)CC/C=C/C(=O)O
InChI
InChI=1S/C10H16O4/c11-9(12)7-5-3-1-2-4-6-8-10(13)14/h5,7H,1-4,6,8H2,(H,11,12)(H,13,14)/b7-5+
InChIKey
XUNMWLWTZWWEIE-FNORWQNLSA-N
Compound name
(E)-dec-2-enedioic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

256
Patents

200.10486 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.11214 146.6
[M+Na]+ 223.09408 151.7
[M-H]- 199.09758 143.4
[M+NH4]+ 218.13868 164.2
[M+K]+ 239.06802 149.6
[M+H-H2O]+ 183.10212 141.6
[M+HCOO]- 245.10306 165.6
[M+CH3COO]- 259.11871 180.3
[M+Na-2H]- 221.07953 148.0
[M]+ 200.10431 147.9
[M]- 200.10541 147.9
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