CID 215242

1h-naphtho(2,1-b)pyran-1-one, 3-(1-pyrrolidinyl)-

Structural Information

Molecular Formula
C17H15NO2
SMILES
C1CCN(C1)C2=CC(=O)C3=C(O2)C=CC4=CC=CC=C43
InChI
InChI=1S/C17H15NO2/c19-14-11-16(18-9-3-4-10-18)20-15-8-7-12-5-1-2-6-13(12)17(14)15/h1-2,5-8,11H,3-4,9-10H2
InChIKey
UJKBOTZAAHYQDF-UHFFFAOYSA-N
Compound name
3-pyrrolidin-1-ylbenzo[f]chromen-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

265.1103 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.11758 157.8
[M+Na]+ 288.09952 174.7
[M+NH4]+ 283.14412 167.9
[M+K]+ 304.07346 167.7
[M-H]- 264.10302 164.6
[M+Na-2H]- 286.08497 166.1
[M]+ 265.10975 162.4
[M]- 265.11085 162.4
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