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]+ 211.14411 148.2
[M+Na]+ 233.12605 153.4
[M-H]- 209.12955 151.3
[M+NH4]+ 228.17065 159.1
[M+K]+ 249.09999 157.1
[M+H-H2O]+ 193.13409 131.5
[M+HCOO]- 255.13503 164.5
[M+CH3COO]- 269.15068 204.3
[M+Na-2H]- 231.11150 151.1
[M]+ 210.13628 151.5
[M]- 210.13738 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.