CID 165120653

Tert-butyl n-[3-(1-hydroxyethyl)oxetan-3-yl]carbamate

Structural Information

Molecular Formula
C10H19NO4
SMILES
CC(C1(COC1)NC(=O)OC(C)(C)C)O
InChI
InChI=1S/C10H19NO4/c1-7(12)10(5-14-6-10)11-8(13)15-9(2,3)4/h7,12H,5-6H2,1-4H3,(H,11,13)
InChIKey
YABDYIWUSMECJF-UHFFFAOYSA-N
Compound name
tert-butyl N-[3-(1-hydroxyethyl)oxetan-3-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

217.13141 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.13869 152.2
[M+Na]+ 240.12063 155.1
[M-H]- 216.12413 154.6
[M+NH4]+ 235.16523 163.7
[M+K]+ 256.09457 160.0
[M+H-H2O]+ 200.12867 142.6
[M+HCOO]- 262.12961 168.9
[M+CH3COO]- 276.14526 189.5
[M+Na-2H]- 238.10608 156.8
[M]+ 217.13086 161.7
[M]- 217.13196 161.7
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