CID 24835535

2-fluoro-6-methyl-7h-(1)benzothiopyrano(3,2-c)quinolin-7-one

Structural Information

Molecular Formula
C17H10FNOS
SMILES
CC1=C2C(=C3C=C(C=CC3=N1)F)SC4=CC=CC=C4C2=O
InChI
InChI=1S/C17H10FNOS/c1-9-15-16(20)11-4-2-3-5-14(11)21-17(15)12-8-10(18)6-7-13(12)19-9/h2-8H,1H3
InChIKey
UXXUGJNOFKNYOG-UHFFFAOYSA-N
Compound name
2-fluoro-6-methylthiochromeno[3,2-c]quinolin-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.04672 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.05400 160.9
[M+Na]+ 318.03594 174.9
[M-H]- 294.03944 166.0
[M+NH4]+ 313.08054 179.4
[M+K]+ 334.00988 167.6
[M+H-H2O]+ 278.04398 152.4
[M+HCOO]- 340.04492 176.5
[M+CH3COO]- 354.06057 173.8
[M+Na-2H]- 316.02139 168.6
[M]+ 295.04617 165.8
[M]- 295.04727 165.8
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.