CID 82662714

Tert-butyl 8-oxa-2,5-diazaspiro[3.5]nonane-5-carboxylate

Structural Information

Molecular Formula
C11H20N2O3
SMILES
CC(C)(C)OC(=O)N1CCOCC12CNC2
InChI
InChI=1S/C11H20N2O3/c1-10(2,3)16-9(14)13-4-5-15-8-11(13)6-12-7-11/h12H,4-8H2,1-3H3
InChIKey
PJOOKTHHBXLUEC-UHFFFAOYSA-N
Compound name
tert-butyl 8-oxa-2,5-diazaspiro[3.5]nonane-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

228.1474 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.154676 151.8
[M+Na]+ 251.136618 155.2
[M-H]- 227.140124 153.1
[M+NH4]+ 246.181223 161.0
[M+K]+ 267.110558 158.5
[M+H-H2O]+ 211.144660 140.5
[M+HCOO]- 273.145601 163.0
[M+CH3COO]- 287.161251 187.1
[M+Na-2H]- 249.122066 157.3
[M]+ 228.14685142 157.0
[M]- 228.14794858 157.0
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

patents stripe