CID 84678519

Tert-butyl 1-formyl-5-azaspiro[2.3]hexane-5-carboxylate

Structural Information

Molecular Formula
C11H17NO3
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CC2C=O
InChI
InChI=1S/C11H17NO3/c1-10(2,3)15-9(14)12-6-11(7-12)4-8(11)5-13/h5,8H,4,6-7H2,1-3H3
InChIKey
UBIDCHDZFOWQKL-UHFFFAOYSA-N
Compound name
tert-butyl 2-formyl-5-azaspiro[2.3]hexane-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.12085 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.12813 152.2
[M+Na]+ 234.11007 160.4
[M-H]- 210.11357 157.6
[M+NH4]+ 229.15467 161.6
[M+K]+ 250.08401 161.7
[M+H-H2O]+ 194.11811 142.8
[M+HCOO]- 256.11905 169.8
[M+CH3COO]- 270.13470 191.9
[M+Na-2H]- 232.09552 157.0
[M]+ 211.12030 165.2
[M]- 211.12140 165.2
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.