CID 53484530

Tert-butyl 1,6-diazaspiro[3.4]octane-6-carboxylate

Structural Information

Molecular Formula
C11H20N2O2
SMILES
CC(C)(C)OC(=O)N1CCC2(C1)CCN2
InChI
InChI=1S/C11H20N2O2/c1-10(2,3)15-9(14)13-7-5-11(8-13)4-6-12-11/h12H,4-8H2,1-3H3
InChIKey
HXUGSDLGHNRSJZ-UHFFFAOYSA-N
Compound name
tert-butyl 1,7-diazaspiro[3.4]octane-7-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

212.15248 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.15976 151.4
[M+Na]+ 235.14170 155.5
[M-H]- 211.14520 152.6
[M+NH4]+ 230.18630 164.4
[M+K]+ 251.11564 157.0
[M+H-H2O]+ 195.14974 141.0
[M+HCOO]- 257.15068 165.4
[M+CH3COO]- 271.16633 184.6
[M+Na-2H]- 233.12715 154.4
[M]+ 212.15193 156.7
[M]- 212.15303 156.7
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