CID 2277241

3-((4-methoxybenzyl)oxy)-4-methyl-7,8,9,10-tetrahydro-6h-benzo(c)chromen-6-one

Structural Information

Molecular Formula
C22H22O4
SMILES
CC1=C(C=CC2=C1OC(=O)C3=C2CCCC3)OCC4=CC=C(C=C4)OC
InChI
InChI=1S/C22H22O4/c1-14-20(25-13-15-7-9-16(24-2)10-8-15)12-11-18-17-5-3-4-6-19(17)22(23)26-21(14)18/h7-12H,3-6,13H2,1-2H3
InChIKey
CEOUIBYAZKLYRB-UHFFFAOYSA-N
Compound name
3-[(4-methoxyphenyl)methoxy]-4-methyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.1518 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.15908 181.8
[M+Na]+ 373.14102 198.6
[M+NH4]+ 368.18562 190.9
[M+K]+ 389.11496 189.5
[M-H]- 349.14452 189.2
[M+Na-2H]- 371.12647 189.0
[M]+ 350.15125 186.6
[M]- 350.15235 186.6
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.