CID 54238

1-((2-furyldimethylsilyl)methyl)hexahydro-1h-azepine hydrochloride

Structural Information

Molecular Formula
C13H23NOSi
SMILES
C[Si](C)(CN1CCCCCC1)C2=CC=CO2
InChI
InChI=1S/C13H23NOSi/c1-16(2,13-8-7-11-15-13)12-14-9-5-3-4-6-10-14/h7-8,11H,3-6,9-10,12H2,1-2H3
InChIKey
XEBKJNOTZGCYIA-UHFFFAOYSA-N
Compound name
azepan-1-ylmethyl-(furan-2-yl)-dimethylsilane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.15489 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.16217 157.6
[M+Na]+ 260.14411 166.0
[M+NH4]+ 255.18871 165.0
[M+K]+ 276.11805 163.1
[M-H]- 236.14761 160.9
[M+Na-2H]- 258.12956 162.6
[M]+ 237.15434 159.7
[M]- 237.15544 159.7
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.