CID 3044955

K 9905

Structural Information

Molecular Formula
C16H15NO3
SMILES
CN(C)C1=CC(=O)C2=C(O1)C(=CC3=CC=CC=C32)OC
InChI
InChI=1S/C16H15NO3/c1-17(2)14-9-12(18)15-11-7-5-4-6-10(11)8-13(19-3)16(15)20-14/h4-9H,1-3H3
InChIKey
HJQITPWVVVVJPO-UHFFFAOYSA-N
Compound name
3-(dimethylamino)-5-methoxybenzo[f]chromen-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.1052 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.11248 157.5
[M+Na]+ 292.09442 174.4
[M+NH4]+ 287.13902 166.9
[M+K]+ 308.06836 166.7
[M-H]- 268.09792 163.7
[M+Na-2H]- 290.07987 165.4
[M]+ 269.10465 161.9
[M]- 269.10575 161.9
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.