CID 16683166

1-[(2,2-dibutyl-1,3,2-dioxastannolan-4-yl)methyl]pyrrolidine

Structural Information

Molecular Formula
C15H31NO2Sn
SMILES
CCCC[Sn]1(OCC(O1)CN2CCCC2)CCCC
InChI
InChI=1S/C7H13NO2.2C4H9.Sn/c9-6-7(10)5-8-3-1-2-4-8;2*1-3-4-2;/h7H,1-6H2;2*1,3-4H2,2H3;/q-2;;;+2
InChIKey
BCFRNVBTEWLIOQ-UHFFFAOYSA-N
Compound name
1-[(2,2-dibutyl-1,3,2-dioxastannolan-4-yl)methyl]pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

377.1377 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.14498 188.6
[M+Na]+ 400.12692 191.0
[M-H]- 376.13042 192.5
[M+NH4]+ 395.17152 205.0
[M+K]+ 416.10086 190.3
[M+H-H2O]+ 360.13496 181.2
[M+HCOO]- 422.13590 204.0
[M+CH3COO]- 436.15155 201.1
[M+Na-2H]- 398.11237 186.5
[M]+ 377.13715 189.3
[M]- 377.13825 189.3
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.