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

48
Patents

201.10011 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.10739 143.4
[M+Na]+ 224.08933 149.4
[M-H]- 200.09283 147.5
[M+NH4]+ 219.13393 162.8
[M+K]+ 240.06327 150.7
[M+H-H2O]+ 184.09737 138.6
[M+HCOO]- 246.09831 164.6
[M+CH3COO]- 260.11396 183.8
[M+Na-2H]- 222.07478 148.0
[M]+ 201.09956 144.3
[M]- 201.10066 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