CID 165732314

1,3-dioxo-2,3-dihydro-1h-isoindol-2-yl 4-[(tert-butyldimethylsilyl)oxy]butanoate

Structural Information

Molecular Formula
C18H25NO5Si
SMILES
CC(C)(C)[Si](C)(C)OCCCC(=O)ON1C(=O)C2=CC=CC=C2C1=O
InChI
InChI=1S/C18H25NO5Si/c1-18(2,3)25(4,5)23-12-8-11-15(20)24-19-16(21)13-9-6-7-10-14(13)17(19)22/h6-7,9-10H,8,11-12H2,1-5H3
InChIKey
CMTVUBSJDZZNNZ-UHFFFAOYSA-N
Compound name
(1,3-dioxoisoindol-2-yl) 4-[tert-butyl(dimethyl)silyl]oxybutanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

363.1502 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.15748 185.2
[M+Na]+ 386.13942 192.1
[M-H]- 362.14292 188.1
[M+NH4]+ 381.18402 200.2
[M+K]+ 402.11336 190.1
[M+H-H2O]+ 346.14746 179.2
[M+HCOO]- 408.14840 201.5
[M+CH3COO]- 422.16405 213.5
[M+Na-2H]- 384.12487 187.3
[M]+ 363.14965 191.8
[M]- 363.15075 191.8
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

No patent data available for this compound.