CID 58622604

870243-67-7

Structural Information

Molecular Formula
C14H17NO4
SMILES
CC(C)(C)OCCON1C(=O)C2=CC=CC=C2C1=O
InChI
InChI=1S/C14H17NO4/c1-14(2,3)18-8-9-19-15-12(16)10-6-4-5-7-11(10)13(15)17/h4-7H,8-9H2,1-3H3
InChIKey
MZLJGLBNSMYYHY-UHFFFAOYSA-N
Compound name
2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]isoindole-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

263.11575 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.12303 159.2
[M+Na]+ 286.10497 169.8
[M+NH4]+ 281.14957 165.6
[M+K]+ 302.07891 166.7
[M-H]- 262.10847 158.6
[M+Na-2H]- 284.09042 162.1
[M]+ 263.11520 160.3
[M]- 263.11630 160.3
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