CID 132308437

2138009-34-2

Structural Information

Molecular Formula
C23H25NO5
SMILES
C1COCCC1(CC(=O)O)CNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C23H25NO5/c25-21(26)13-23(9-11-28-12-10-23)15-24-22(27)29-14-20-18-7-3-1-5-16(18)17-6-2-4-8-19(17)20/h1-8,20H,9-15H2,(H,24,27)(H,25,26)
InChIKey
QVDGSAJWCMALQG-UHFFFAOYSA-N
Compound name
2-[4-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]oxan-4-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

395.17328 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 396.18056 194.7
[M+Na]+ 418.16250 204.2
[M+NH4]+ 413.20710 202.7
[M+K]+ 434.13644 198.0
[M-H]- 394.16600 199.0
[M+Na-2H]- 416.14795 198.8
[M]+ 395.17273 197.1
[M]- 395.17383 197.1
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.