CID 9548024

(2z)-2,4-dihydroxydec-2-enedioate

Structural Information

Molecular Formula
C10H16O6
SMILES
C(CCC(/C=C(\C(=O)O)/O)O)CCC(=O)O
InChI
InChI=1S/C10H16O6/c11-7(6-8(12)10(15)16)4-2-1-3-5-9(13)14/h6-7,11-12H,1-5H2,(H,13,14)(H,15,16)/b8-6+
InChIKey
OGKPPXBYJFCQLK-SOFGYWHQSA-N
Compound name
(E)-2,4-dihydroxydec-2-enedioic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

232.09468 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.10196 152.9
[M+Na]+ 255.08390 156.5
[M-H]- 231.08740 146.9
[M+NH4]+ 250.12850 167.4
[M+K]+ 271.05784 154.8
[M+H-H2O]+ 215.09194 147.9
[M+HCOO]- 277.09288 167.3
[M+CH3COO]- 291.10853 181.8
[M+Na-2H]- 253.06935 150.8
[M]+ 232.09413 151.9
[M]- 232.09523 151.9
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.