CID 361186

115560-63-9

Structural Information

Molecular Formula
C20H12O2
SMILES
CC1=CC2=C(C3=C4C(=C2)C=CC5=C4C(=CC=C5)C=C3)OC1=O
InChI
InChI=1S/C20H12O2/c1-11-9-15-10-14-6-5-12-3-2-4-13-7-8-16(18(14)17(12)13)19(15)22-20(11)21/h2-10H,1H3
InChIKey
WKJZTIANXYCMHV-UHFFFAOYSA-N
Compound name
8-methylpyreno[1,2-b]pyran-9-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.08374 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.09102 162.4
[M+Na]+ 307.07296 175.5
[M-H]- 283.07646 170.4
[M+NH4]+ 302.11756 181.7
[M+K]+ 323.04690 170.4
[M+H-H2O]+ 267.08100 153.3
[M+HCOO]- 329.08194 182.7
[M+CH3COO]- 343.09759 176.0
[M+Na-2H]- 305.05841 174.9
[M]+ 284.08319 170.0
[M]- 284.08429 170.0
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.