CID 2756185

867062-95-1

Structural Information

Molecular Formula
C24H29NO7
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCOCCOCCOCCC(=O)O
InChI
InChI=1S/C24H29NO7/c26-23(27)9-11-29-13-15-31-16-14-30-12-10-25-24(28)32-17-22-20-7-3-1-5-18(20)19-6-2-4-8-21(19)22/h1-8,22H,9-17H2,(H,25,28)(H,26,27)
InChIKey
CHIDDYZONKDHLG-UHFFFAOYSA-N
Compound name
3-[2-[2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethoxy]ethoxy]ethoxy]propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

253
Patents

443.1944 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 444.20168 206.8
[M+Na]+ 466.18362 214.2
[M+NH4]+ 461.22822 210.9
[M+K]+ 482.15756 210.3
[M-H]- 442.18712 206.4
[M+Na-2H]- 464.16907 207.2
[M]+ 443.19385 207.2
[M]- 443.19495 207.2
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

patents stripe