CID 14591859

5-[(tert-butyldimethylsilyl)oxy]pent-2-ynal

Structural Information

Molecular Formula
C11H20O2Si
SMILES
CC(C)(C)[Si](C)(C)OCCC#CC=O
InChI
InChI=1S/C11H20O2Si/c1-11(2,3)14(4,5)13-10-8-6-7-9-12/h9H,8,10H2,1-5H3
InChIKey
JRAGDQSEYMJYRC-UHFFFAOYSA-N
Compound name
5-[tert-butyl(dimethyl)silyl]oxypent-2-ynal
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

212.12326 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.13054 150.9
[M+Na]+ 235.11248 159.4
[M-H]- 211.11598 150.6
[M+NH4]+ 230.15708 168.8
[M+K]+ 251.08642 158.0
[M+H-H2O]+ 195.12052 140.8
[M+HCOO]- 257.12146 165.3
[M+CH3COO]- 271.13711 193.3
[M+Na-2H]- 233.09793 155.4
[M]+ 212.12271 149.3
[M]- 212.12381 149.3
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

patents stripe