CID 2728135

Maybridge1_006619

Structural Information

Molecular Formula
C19H18N2O4
SMILES
CC(=O)NC1=CC(=CC=C1)OCCCN2C(=O)C3=CC=CC=C3C2=O
InChI
InChI=1S/C19H18N2O4/c1-13(22)20-14-6-4-7-15(12-14)25-11-5-10-21-18(23)16-8-2-3-9-17(16)19(21)24/h2-4,6-9,12H,5,10-11H2,1H3,(H,20,22)
InChIKey
ZSIBJEPXULOXBH-UHFFFAOYSA-N
Compound name
N-[3-[3-(1,3-dioxoisoindol-2-yl)propoxy]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

338.12665 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.133926 178.0
[M+Na]+ 361.115868 185.4
[M-H]- 337.119374 184.5
[M+NH4]+ 356.160473 192.6
[M+K]+ 377.089808 181.2
[M+H-H2O]+ 321.123910 169.5
[M+HCOO]- 383.124851 199.8
[M+CH3COO]- 397.140501 213.4
[M+Na-2H]- 359.101316 179.7
[M]+ 338.12610142 181.2
[M]- 338.12719858 181.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.