CID 147931383

N-(2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)-n-methylglycine

Structural Information

Molecular Formula
C16H15N3O6
SMILES
CN(CC(=O)O)C1=CC=CC2=C1C(=O)N(C2=O)C3CCC(=O)NC3=O
InChI
InChI=1S/C16H15N3O6/c1-18(7-12(21)22)9-4-2-3-8-13(9)16(25)19(15(8)24)10-5-6-11(20)17-14(10)23/h2-4,10H,5-7H2,1H3,(H,21,22)(H,17,20,23)
InChIKey
IJYBMYZTACXTCW-UHFFFAOYSA-N
Compound name
2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]-methylamino]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

345.0961 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.10338 174.4
[M+Na]+ 368.08532 181.1
[M-H]- 344.08882 178.2
[M+NH4]+ 363.12992 186.3
[M+K]+ 384.05926 178.0
[M+H-H2O]+ 328.09336 166.7
[M+HCOO]- 390.09430 189.5
[M+CH3COO]- 404.10995 213.9
[M+Na-2H]- 366.07077 172.5
[M]+ 345.09555 172.8
[M]- 345.09665 172.8
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