CID 112693924

1314778-71-6

Structural Information

Molecular Formula
C15H19NO4
SMILES
CC(C)(C)OC(=O)NC1=CC=C(C=C1)C2(CC2)C(=O)O
InChI
InChI=1S/C15H19NO4/c1-14(2,3)20-13(19)16-11-6-4-10(5-7-11)15(8-9-15)12(17)18/h4-7H,8-9H2,1-3H3,(H,16,19)(H,17,18)
InChIKey
YQFVRQRUIKFSJF-UHFFFAOYSA-N
Compound name
1-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.1314 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.13868 166.6
[M+Na]+ 300.12062 177.2
[M+NH4]+ 295.16522 174.3
[M+K]+ 316.09456 173.1
[M-H]- 276.12412 174.5
[M+Na-2H]- 298.10607 175.1
[M]+ 277.13085 171.4
[M]- 277.13195 171.4
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.