CID 225627

2-acetamido-9-fluorenyl acetate

Structural Information

Molecular Formula
C17H15NO3
SMILES
CC(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3C2OC(=O)C
InChI
InChI=1S/C17H15NO3/c1-10(19)18-12-7-8-14-13-5-3-4-6-15(13)17(16(14)9-12)21-11(2)20/h3-9,17H,1-2H3,(H,18,19)
InChIKey
WOIUBMJAWAWJMB-UHFFFAOYSA-N
Compound name
(2-acetamido-9H-fluoren-9-yl) acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

281.1052 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.11248 163.5
[M+Na]+ 304.09442 171.7
[M-H]- 280.09792 169.4
[M+NH4]+ 299.13902 183.2
[M+K]+ 320.06836 168.1
[M+H-H2O]+ 264.10246 157.2
[M+HCOO]- 326.10340 185.7
[M+CH3COO]- 340.11905 203.8
[M+Na-2H]- 302.07987 167.1
[M]+ 281.10465 166.4
[M]- 281.10575 166.4
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

patents stripe