CID 154853416

2383165-04-4

Structural Information

Molecular Formula
C11H16N2O5
SMILES
CC1=C(OC(=N1)CNC(=O)OC(C)(C)C)C(=O)O
InChI
InChI=1S/C11H16N2O5/c1-6-8(9(14)15)17-7(13-6)5-12-10(16)18-11(2,3)4/h5H2,1-4H3,(H,12,16)(H,14,15)
InChIKey
BZURFLDHYTVNHC-UHFFFAOYSA-N
Compound name
4-methyl-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]-1,3-oxazole-5-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.10593 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.11321 156.8
[M+Na]+ 279.09515 164.0
[M-H]- 255.09865 159.1
[M+NH4]+ 274.13975 172.3
[M+K]+ 295.06909 164.7
[M+H-H2O]+ 239.10319 150.9
[M+HCOO]- 301.10413 176.7
[M+CH3COO]- 315.11978 193.7
[M+Na-2H]- 277.08060 160.0
[M]+ 256.10538 161.1
[M]- 256.10648 161.1
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

No patent data available for this compound.