CID 6436479

2-methoxyethyl hydrogen maleate

Structural Information

Molecular Formula
C7H10O5
SMILES
COCCOC(=O)/C=C\C(=O)O
InChI
InChI=1S/C7H10O5/c1-11-4-5-12-7(10)3-2-6(8)9/h2-3H,4-5H2,1H3,(H,8,9)/b3-2-
InChIKey
ZOVIVPPZCMSLMJ-IHWYPQMZSA-N
Compound name
(Z)-4-(2-methoxyethoxy)-4-oxobut-2-enoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

142
Patents

174.05283 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.060106 134.4
[M+Na]+ 197.042048 141.3
[M-H]- 173.045554 133.3
[M+NH4]+ 192.086653 153.8
[M+K]+ 213.015988 141.4
[M+H-H2O]+ 157.050090 129.6
[M+HCOO]- 219.051031 156.3
[M+CH3COO]- 233.066681 175.2
[M+Na-2H]- 195.027496 138.2
[M]+ 174.05228142 137.9
[M]- 174.05337858 137.9
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

patents stripe