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]+ 231.10158 147.0
[M+Na]+ 253.08352 157.9
[M-H]- 229.08702 154.1
[M+NH4]+ 248.12812 168.4
[M+K]+ 269.05746 155.6
[M+H-H2O]+ 213.09156 141.8
[M+HCOO]- 275.09250 168.8
[M+CH3COO]- 289.10815 161.6
[M+Na-2H]- 251.06897 153.3
[M]+ 230.09375 151.4
[M]- 230.09485 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.