CID 136575488

1256156-45-2

Structural Information

Molecular Formula
C11H15NO5
SMILES
CC(C)(C)OC(=O)NCC1=C(C=CO1)C(=O)O
InChI
InChI=1S/C11H15NO5/c1-11(2,3)17-10(15)12-6-8-7(9(13)14)4-5-16-8/h4-5H,6H2,1-3H3,(H,12,15)(H,13,14)
InChIKey
NJYUCVXLDQXPBZ-UHFFFAOYSA-N
Compound name
2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]furan-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.09502 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.10230 153.3
[M+Na]+ 264.08424 160.4
[M+NH4]+ 259.12884 158.0
[M+K]+ 280.05818 160.8
[M-H]- 240.08774 152.6
[M+Na-2H]- 262.06969 154.7
[M]+ 241.09447 153.6
[M]- 241.09557 153.6
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.