CID 146080997

2171965-43-6

Structural Information

Molecular Formula
C14H26N2O4
SMILES
CC(C)(C)OC(=O)N1CCC2(CC1)COCC(O2)CN
InChI
InChI=1S/C14H26N2O4/c1-13(2,3)20-12(17)16-6-4-14(5-7-16)10-18-9-11(8-15)19-14/h11H,4-10,15H2,1-3H3
InChIKey
PHAPVYMZJHFXMB-UHFFFAOYSA-N
Compound name
tert-butyl 2-(aminomethyl)-1,4-dioxa-9-azaspiro[5.5]undecane-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.18927 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.19655 169.0
[M+Na]+ 309.17849 171.8
[M-H]- 285.18199 172.6
[M+NH4]+ 304.22309 182.3
[M+K]+ 325.15243 173.4
[M+H-H2O]+ 269.18653 162.1
[M+HCOO]- 331.18747 180.4
[M+CH3COO]- 345.20312 199.5
[M+Na-2H]- 307.16394 173.3
[M]+ 286.18872 164.9
[M]- 286.18982 164.9
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.