CID 2888491

7-methoxy-6-methyl-2,3-dihydro-1h-cyclopenta[c]chromen-4-one

Structural Information

Molecular Formula
C14H14O3
SMILES
CC1=C(C=CC2=C1OC(=O)C3=C2CCC3)OC
InChI
InChI=1S/C14H14O3/c1-8-12(16-2)7-6-10-9-4-3-5-11(9)14(15)17-13(8)10/h6-7H,3-5H2,1-2H3
InChIKey
YGXDFJQPDFEATJ-UHFFFAOYSA-N
Compound name
7-methoxy-6-methyl-2,3-dihydro-1H-cyclopenta[c]chromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.0943 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.101576 147.0
[M+Na]+ 253.083518 157.9
[M-H]- 229.087024 154.1
[M+NH4]+ 248.128123 168.4
[M+K]+ 269.057458 155.6
[M+H-H2O]+ 213.091560 141.8
[M+HCOO]- 275.092501 168.8
[M+CH3COO]- 289.108151 161.6
[M+Na-2H]- 251.068966 153.3
[M]+ 230.09375142 151.4
[M]- 230.09484858 151.4
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

No patent data available for this compound.