CID 14084681

3-methyl-5-(trimethylsilyl)pent-4-yn-2-ol

Structural Information

Molecular Formula
C9H18OSi
SMILES
CC(C#C[Si](C)(C)C)C(C)O
InChI
InChI=1S/C9H18OSi/c1-8(9(2)10)6-7-11(3,4)5/h8-10H,1-5H3
InChIKey
QREYWZDZPBFOBL-UHFFFAOYSA-N
Compound name
3-methyl-5-trimethylsilylpent-4-yn-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.11269 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.11997 140.9
[M+Na]+ 193.10191 148.8
[M-H]- 169.10541 139.5
[M+NH4]+ 188.14651 159.5
[M+K]+ 209.07585 147.3
[M+H-H2O]+ 153.10995 131.1
[M+HCOO]- 215.11089 153.8
[M+CH3COO]- 229.12654 186.3
[M+Na-2H]- 191.08736 143.0
[M]+ 170.11214 135.5
[M]- 170.11324 135.5
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.