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

4
Patents

217.13141 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.138686 152.2
[M+Na]+ 240.120628 155.1
[M-H]- 216.124134 154.6
[M+NH4]+ 235.165233 163.7
[M+K]+ 256.094568 160.0
[M+H-H2O]+ 200.128670 142.6
[M+HCOO]- 262.129611 168.9
[M+CH3COO]- 276.145261 189.5
[M+Na-2H]- 238.106076 156.8
[M]+ 217.13086142 161.7
[M]- 217.13195858 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