CID 165768782

2167305-00-0

Structural Information

Molecular Formula
C13H24N2O3
SMILES
CC(C)(C)OC(=O)NC1CC2(C1)CC(CCO2)N
InChI
InChI=1S/C13H24N2O3/c1-12(2,3)18-11(16)15-10-7-13(8-10)6-9(14)4-5-17-13/h9-10H,4-8,14H2,1-3H3,(H,15,16)
InChIKey
SCVNJVQJOWBBHP-UHFFFAOYSA-N
Compound name
tert-butyl N-(8-amino-5-oxaspiro[3.5]nonan-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.17868 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.18596 160.6
[M+Na]+ 279.16790 162.2
[M-H]- 255.17140 165.2
[M+NH4]+ 274.21250 171.1
[M+K]+ 295.14184 166.0
[M+H-H2O]+ 239.17594 149.5
[M+HCOO]- 301.17688 176.2
[M+CH3COO]- 315.19253 200.6
[M+Na-2H]- 277.15335 164.4
[M]+ 256.17813 165.1
[M]- 256.17923 165.1
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.