CID 91667245

1557287-99-6

Structural Information

Molecular Formula
C20H44N2O2Sn
SMILES
CCCC[Sn](CCCC)(CCCC)CN(CCN)C(=O)OC(C)(C)C
InChI
InChI=1S/C8H17N2O2.3C4H9.Sn/c1-8(2,3)12-7(11)10(4)6-5-9;3*1-3-4-2;/h4-6,9H2,1-3H3;3*1,3-4H2,2H3;
InChIKey
LGYNPAYNCSWDHV-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-aminoethyl)-N-(tributylstannylmethyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

464.2425 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 465.249776 220.5
[M+Na]+ 487.231718 220.2
[M-H]- 463.235224 218.7
[M+NH4]+ 482.276323 232.9
[M+K]+ 503.205658 218.4
[M+H-H2O]+ 447.239760 212.5
[M+HCOO]- 509.240701 238.9
[M+CH3COO]- 523.256351 231.5
[M+Na-2H]- 485.217166 216.8
[M]+ 464.24195142 226.4
[M]- 464.24304858 226.4
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