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

10
Patents

184.0848 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.09208 139.1
[M+Na]+ 207.07402 146.5
[M-H]- 183.07752 142.3
[M+NH4]+ 202.11862 157.9
[M+K]+ 223.04796 147.6
[M+H-H2O]+ 167.08206 133.0
[M+HCOO]- 229.08300 161.8
[M+CH3COO]- 243.09865 180.2
[M+Na-2H]- 205.05947 146.3
[M]+ 184.08425 141.8
[M]- 184.08535 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