CID 39317

Brn 0811073

Structural Information

Molecular Formula
C18H17NO3
SMILES
C1COCCN1CC2=CC3=C(C=C2O)C4=CC=CC=C4C3=O
InChI
InChI=1S/C18H17NO3/c20-17-10-15-13-3-1-2-4-14(13)18(21)16(15)9-12(17)11-19-5-7-22-8-6-19/h1-4,9-10,20H,5-8,11H2
InChIKey
NCFRPAMUESEKHG-UHFFFAOYSA-N
Compound name
3-hydroxy-2-(morpholin-4-ylmethyl)fluoren-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.12085 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.128126 166.8
[M+Na]+ 318.110068 174.7
[M-H]- 294.113574 173.2
[M+NH4]+ 313.154673 182.5
[M+K]+ 334.084008 170.3
[M+H-H2O]+ 278.118110 159.0
[M+HCOO]- 340.119051 182.8
[M+CH3COO]- 354.134701 177.9
[M+Na-2H]- 316.095516 170.2
[M]+ 295.12030142 165.6
[M]- 295.12139858 165.6
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.