CID 2392335

1-(4-chloro-2-methoxy-5-methylphenyl)-2,5-dihydro-1h-pyrrole-2,5-dione

Structural Information

Molecular Formula
C12H10ClNO3
SMILES
CC1=CC(=C(C=C1Cl)OC)N2C(=O)C=CC2=O
InChI
InChI=1S/C12H10ClNO3/c1-7-5-9(10(17-2)6-8(7)13)14-11(15)3-4-12(14)16/h3-6H,1-2H3
InChIKey
MLCLPRDEYYUNCY-UHFFFAOYSA-N
Compound name
1-(4-chloro-2-methoxy-5-methylphenyl)pyrrole-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

251.03493 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.04221 151.5
[M+Na]+ 274.02415 166.0
[M+NH4]+ 269.06875 159.3
[M+K]+ 289.99809 161.1
[M-H]- 250.02765 154.0
[M+Na-2H]- 272.00960 157.9
[M]+ 251.03438 154.5
[M]- 251.03548 154.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.