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
1
Annotation Hits

0
References

107
Patents

174.05283 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.06011 134.4
[M+Na]+ 197.04205 141.3
[M-H]- 173.04555 133.3
[M+NH4]+ 192.08665 153.8
[M+K]+ 213.01599 141.4
[M+H-H2O]+ 157.05009 129.6
[M+HCOO]- 219.05103 156.3
[M+CH3COO]- 233.06668 175.2
[M+Na-2H]- 195.02750 138.2
[M]+ 174.05228 137.9
[M]- 174.05338 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