CID 165665401

2803861-56-3

Structural Information

Molecular Formula
C11H18N2O2
SMILES
CC(C)(C)OC(=O)CNC1CC(C1)C#N
InChI
InChI=1S/C11H18N2O2/c1-11(2,3)15-10(14)7-13-9-4-8(5-9)6-12/h8-9,13H,4-5,7H2,1-3H3
InChIKey
HSAMTIRGLZLFIV-UHFFFAOYSA-N
Compound name
tert-butyl 2-[(3-cyanocyclobutyl)amino]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.13683 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.144106 148.2
[M+Na]+ 233.126048 153.4
[M-H]- 209.129554 151.3
[M+NH4]+ 228.170653 159.1
[M+K]+ 249.099988 157.1
[M+H-H2O]+ 193.134090 131.5
[M+HCOO]- 255.135031 164.5
[M+CH3COO]- 269.150681 204.3
[M+Na-2H]- 231.111496 151.1
[M]+ 210.13628142 151.5
[M]- 210.13737858 151.5
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.