CID 134218841

Tert-butyl 1-oxa-10-azadispiro[2.0.4^{4}.4^{3}]dodecane-10-carboxylate

Structural Information

Molecular Formula
C15H25NO3
SMILES
CC(C)(C)OC(=O)N1CCC2(CO2)C3(C1)CCCC3
InChI
InChI=1S/C15H25NO3/c1-13(2,3)19-12(17)16-9-8-15(11-18-15)14(10-16)6-4-5-7-14/h4-11H2,1-3H3
InChIKey
ZFYQZESWDKQADZ-UHFFFAOYSA-N
Compound name
tert-butyl 2-oxa-10-azadispiro[2.0.44.43]dodecane-10-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

267.18344 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.190716 168.4
[M+Na]+ 290.172658 174.9
[M-H]- 266.176164 175.1
[M+NH4]+ 285.217263 183.5
[M+K]+ 306.146598 175.2
[M+H-H2O]+ 250.180700 163.3
[M+HCOO]- 312.181641 181.2
[M+CH3COO]- 326.197291 195.2
[M+Na-2H]- 288.158106 172.4
[M]+ 267.18289142 168.5
[M]- 267.18398858 168.5
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

patents stripe