CID 70700471

Tert-butyl 2-cyanomorpholine-4-carboxylate

Structural Information

Molecular Formula
C10H16N2O3
SMILES
CC(C)(C)OC(=O)N1CCOC(C1)C#N
InChI
InChI=1S/C10H16N2O3/c1-10(2,3)15-9(13)12-4-5-14-8(6-11)7-12/h8H,4-5,7H2,1-3H3
InChIKey
GZZBGWUQUIKDNN-UHFFFAOYSA-N
Compound name
tert-butyl 2-cyanomorpholine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.11609 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.12337 148.9
[M+Na]+ 235.10531 157.7
[M+NH4]+ 230.14991 151.7
[M+K]+ 251.07925 151.3
[M-H]- 211.10881 142.0
[M+Na-2H]- 233.09076 149.1
[M]+ 212.11554 147.1
[M]- 212.11664 147.1
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.