CID 90358615

1393732-56-3

Structural Information

Molecular Formula
C10H19NO4
SMILES
CC(C)(C)OC(=O)N1CC(C1)C(CO)O
InChI
InChI=1S/C10H19NO4/c1-10(2,3)15-9(14)11-4-7(5-11)8(13)6-12/h7-8,12-13H,4-6H2,1-3H3
InChIKey
RTZOSQFRADBDJU-UHFFFAOYSA-N
Compound name
tert-butyl 3-(1,2-dihydroxyethyl)azetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
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 153.1
[M+Na]+ 240.120628 156.7
[M-H]- 216.124134 152.2
[M+NH4]+ 235.165233 162.5
[M+K]+ 256.094568 159.5
[M+H-H2O]+ 200.128670 142.2
[M+HCOO]- 262.129611 167.0
[M+CH3COO]- 276.145261 186.4
[M+Na-2H]- 238.106076 154.0
[M]+ 217.13086142 161.5
[M]- 217.13195858 161.5
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

patents stripe