CID 138991483

2309457-53-0

Structural Information

Molecular Formula
C10H17NO2
SMILES
COC(=O)C1(CC(C1)C2CCC2)N
InChI
InChI=1S/C10H17NO2/c1-13-9(12)10(11)5-8(6-10)7-3-2-4-7/h7-8H,2-6,11H2,1H3
InChIKey
IITPUUOFBNMRNP-UHFFFAOYSA-N
Compound name
methyl 1-amino-3-cyclobutylcyclobutane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.12593 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.133206 139.5
[M+Na]+ 206.115148 142.0
[M-H]- 182.118654 144.9
[M+NH4]+ 201.159753 147.0
[M+K]+ 222.089088 147.0
[M+H-H2O]+ 166.123190 125.3
[M+HCOO]- 228.124131 157.1
[M+CH3COO]- 242.139781 195.6
[M+Na-2H]- 204.100596 141.8
[M]+ 183.12538142 153.1
[M]- 183.12647858 153.1
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.