CID 165905376

2010488-82-9

Structural Information

Molecular Formula
C11H22N2O3
SMILES
CC(C)(C)OC(=O)NC1(CC(C1)OC)CN
InChI
InChI=1S/C11H22N2O3/c1-10(2,3)16-9(14)13-11(7-12)5-8(6-11)15-4/h8H,5-7,12H2,1-4H3,(H,13,14)
InChIKey
YGMGCUCVRQYUJO-UHFFFAOYSA-N
Compound name
tert-butyl N-[1-(aminomethyl)-3-methoxycyclobutyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.16304 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.17032 158.7
[M+Na]+ 253.15226 161.9
[M-H]- 229.15576 161.3
[M+NH4]+ 248.19686 171.3
[M+K]+ 269.12620 165.2
[M+H-H2O]+ 213.16030 148.3
[M+HCOO]- 275.16124 178.3
[M+CH3COO]- 289.17689 197.4
[M+Na-2H]- 251.13771 161.7
[M]+ 230.16249 167.5
[M]- 230.16359 167.5
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.