CID 11730273

105251-52-3

Structural Information

Molecular Formula
C24H45N3O2Si2
SMILES
CC(C)(C)[Si](C)(C)OC[C@@H]1CC/C(=C(\C#N)/C2=N[C@@H](CC2)CO[Si](C)(C)C(C)(C)C)/N1
InChI
InChI=1S/C24H45N3O2Si2/c1-23(2,3)30(7,8)28-16-18-11-13-21(26-18)20(15-25)22-14-12-19(27-22)17-29-31(9,10)24(4,5)6/h18-19,26H,11-14,16-17H2,1-10H3/b21-20-/t18-,19-/m0/s1
InChIKey
JYNLYWZVXIGLJC-GLHDQHDCSA-N
Compound name
(2E)-2-[(2S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-3,4-dihydro-2H-pyrrol-5-yl]-2-[(5S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrrolidin-2-ylidene]acetonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

463.30502 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 464.31230 218.8
[M+Na]+ 486.29424 221.5
[M-H]- 462.29774 219.2
[M+NH4]+ 481.33884 227.5
[M+K]+ 502.26818 217.9
[M+H-H2O]+ 446.30228 205.2
[M+HCOO]- 508.30322 223.0
[M+CH3COO]- 522.31887 236.3
[M+Na-2H]- 484.27969 214.9
[M]+ 463.30447 213.0
[M]- 463.30557 213.0
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