CID 55295697

Tert-butyl n-(1,3-oxazol-4-yl)carbamate

Structural Information

Molecular Formula
C8H12N2O3
SMILES
CC(C)(C)OC(=O)NC1=COC=N1
InChI
InChI=1S/C8H12N2O3/c1-8(2,3)13-7(11)10-6-4-12-5-9-6/h4-5H,1-3H3,(H,10,11)
InChIKey
FHSAVSFTBFWLRS-UHFFFAOYSA-N
Compound name
tert-butyl N-(1,3-oxazol-4-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

184.0848 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.092076 139.1
[M+Na]+ 207.074018 146.5
[M-H]- 183.077524 142.3
[M+NH4]+ 202.118623 157.9
[M+K]+ 223.047958 147.6
[M+H-H2O]+ 167.082060 133.0
[M+HCOO]- 229.083001 161.8
[M+CH3COO]- 243.098651 180.2
[M+Na-2H]- 205.059466 146.3
[M]+ 184.08425142 141.8
[M]- 184.08534858 141.8
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