CID 122163358

Tert-butyl n-[2-(3-hydroxycyclobutyl)ethyl]carbamate

Structural Information

Molecular Formula
C11H21NO3
SMILES
CC(C)(C)OC(=O)NCCC1CC(C1)O
InChI
InChI=1S/C11H21NO3/c1-11(2,3)15-10(14)12-5-4-8-6-9(13)7-8/h8-9,13H,4-7H2,1-3H3,(H,12,14)
InChIKey
KTEWHLLTEGUAAD-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-(3-hydroxycyclobutyl)ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

215.15215 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.159426 153.3
[M+Na]+ 238.141368 156.4
[M-H]- 214.144874 155.0
[M+NH4]+ 233.185973 164.6
[M+K]+ 254.115308 158.9
[M+H-H2O]+ 198.149410 142.5
[M+HCOO]- 260.150351 171.4
[M+CH3COO]- 274.166001 191.1
[M+Na-2H]- 236.126816 155.6
[M]+ 215.15160142 161.8
[M]- 215.15269858 161.8
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

patents stripe