CID 16683176

Nsc633511

Structural Information

Molecular Formula
C15H31NO3Sn
SMILES
CCCC[Sn]1(OCC(O1)CN2CCOCC2)CCCC
InChI
InChI=1S/C7H13NO3.2C4H9.Sn/c9-6-7(10)5-8-1-3-11-4-2-8;2*1-3-4-2;/h7H,1-6H2;2*1,3-4H2,2H3;/q-2;;;+2
InChIKey
ZGBONOUZBPJZFF-UHFFFAOYSA-N
Compound name
4-[(2,2-dibutyl-1,3,2-dioxastannolan-4-yl)methyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

393.1326 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 394.13988 192.4
[M+Na]+ 416.12182 194.0
[M-H]- 392.12532 196.5
[M+NH4]+ 411.16642 204.9
[M+K]+ 432.09576 194.7
[M+H-H2O]+ 376.12986 184.2
[M+HCOO]- 438.13080 204.8
[M+CH3COO]- 452.14645 203.6
[M+Na-2H]- 414.10727 192.4
[M]+ 393.13205 193.0
[M]- 393.13315 193.0
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.