CID 265849

7-(dimethylamino)-3,4-benzocoumarin

Structural Information

Molecular Formula
C15H13NO2
SMILES
CN(C)C1=CC2=C(C=C1)C3=CC=CC=C3C(=O)O2
InChI
InChI=1S/C15H13NO2/c1-16(2)10-7-8-12-11-5-3-4-6-13(11)15(17)18-14(12)9-10/h3-9H,1-2H3
InChIKey
BEMAPOPZFOZVDQ-UHFFFAOYSA-N
Compound name
3-(dimethylamino)benzo[c]chromen-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

239.09464 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.10192 149.5
[M+Na]+ 262.08386 166.8
[M+NH4]+ 257.12846 159.7
[M+K]+ 278.05780 158.6
[M-H]- 238.08736 156.3
[M+Na-2H]- 260.06931 158.5
[M]+ 239.09409 154.2
[M]- 239.09519 154.2
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

patents stripe