CID 71437572

Tert-butyl n-(4-oxooxolan-3-yl)carbamate

Structural Information

Molecular Formula
C9H15NO4
SMILES
CC(C)(C)OC(=O)NC1COCC1=O
InChI
InChI=1S/C9H15NO4/c1-9(2,3)14-8(12)10-6-4-13-5-7(6)11/h6H,4-5H2,1-3H3,(H,10,12)
InChIKey
YPCCJSNMIHLMOS-UHFFFAOYSA-N
Compound name
tert-butyl N-(4-oxooxolan-3-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

201.10011 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.107386 143.4
[M+Na]+ 224.089328 149.4
[M-H]- 200.092834 147.5
[M+NH4]+ 219.133933 162.8
[M+K]+ 240.063268 150.7
[M+H-H2O]+ 184.097370 138.6
[M+HCOO]- 246.098311 164.6
[M+CH3COO]- 260.113961 183.8
[M+Na-2H]- 222.074776 148.0
[M]+ 201.09956142 144.3
[M]- 201.10065858 144.3
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