CID 40507920

Maltoryzine

Structural Information

Molecular Formula
C11H12O4
SMILES
C/C=C/CC(=O)C1=C(C=CC(=C1O)O)O
InChI
InChI=1S/C11H12O4/c1-2-3-4-7(12)10-8(13)5-6-9(14)11(10)15/h2-3,5-6,13-15H,4H2,1H3/b3-2+
InChIKey
WGGOBKYQLMXALJ-NSCUHMNNSA-N
Compound name
(E)-1-(2,3,6-trihydroxyphenyl)pent-3-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

208.07356 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.080836 143.5
[M+Na]+ 231.062778 151.7
[M-H]- 207.066284 143.7
[M+NH4]+ 226.107383 160.8
[M+K]+ 247.036718 148.2
[M+H-H2O]+ 191.070820 138.5
[M+HCOO]- 253.071761 163.1
[M+CH3COO]- 267.087411 180.0
[M+Na-2H]- 229.048226 145.9
[M]+ 208.07301142 143.3
[M]- 208.07410858 143.3
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