CID 155293252

Ns00073802

Structural Information

Molecular Formula
C15H21NO6
SMILES
C[C@H](CNC(=O)C1=CC=CC=C1OCC(=O)O)OCCOC
InChI
InChI=1S/C15H21NO6/c1-11(21-8-7-20-2)9-16-15(19)12-5-3-4-6-13(12)22-10-14(17)18/h3-6,11H,7-10H2,1-2H3,(H,16,19)(H,17,18)/t11-/m1/s1
InChIKey
WYJHRLHSDNUECQ-LLVKDONJSA-N
Compound name
2-[2-[[(2R)-2-(2-methoxyethoxy)propyl]carbamoyl]phenoxy]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.1369 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.14418 171.2
[M+Na]+ 334.12612 174.9
[M-H]- 310.12962 172.6
[M+NH4]+ 329.17072 184.3
[M+K]+ 350.10006 174.5
[M+H-H2O]+ 294.13416 163.5
[M+HCOO]- 356.13510 191.9
[M+CH3COO]- 370.15075 205.7
[M+Na-2H]- 332.11157 171.9
[M]+ 311.13635 176.2
[M]- 311.13745 176.2
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.