CID 97300468

2309431-89-6

Structural Information

Molecular Formula
C10H19NO3
SMILES
CCO[C@@H]1C[C@](C1(C)C)(C(=O)OC)N
InChI
InChI=1S/C10H19NO3/c1-5-14-7-6-10(11,8(12)13-4)9(7,2)3/h7H,5-6,11H2,1-4H3/t7-,10-/m1/s1
InChIKey
XVQPEWONSTYETA-GMSGAONNSA-N
Compound name
methyl (1S,3R)-1-amino-3-ethoxy-2,2-dimethylcyclobutane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.13649 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.14377 149.2
[M+Na]+ 224.12571 153.2
[M+NH4]+ 219.17031 154.5
[M+K]+ 240.09965 147.6
[M-H]- 200.12921 146.5
[M+Na-2H]- 222.11116 151.8
[M]+ 201.13594 147.8
[M]- 201.13704 147.8
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.