CID 137698933

2137687-82-0

Structural Information

Molecular Formula
C18H17NO5
SMILES
CC(C(=O)O)ONC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C18H17NO5/c1-11(17(20)21)24-19-18(22)23-10-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)16/h2-9,11,16H,10H2,1H3,(H,19,22)(H,20,21)
InChIKey
LLTVQTCVRBPRME-UHFFFAOYSA-N
Compound name
2-(9H-fluoren-9-ylmethoxycarbonylamino)oxypropanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

327.1107 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.11798 174.0
[M+Na]+ 350.09992 183.5
[M+NH4]+ 345.14452 180.4
[M+K]+ 366.07386 180.7
[M-H]- 326.10342 174.7
[M+Na-2H]- 348.08537 176.7
[M]+ 327.11015 175.2
[M]- 327.11125 175.2
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.