CID 854115

374758-53-9

Structural Information

Molecular Formula
C19H18O3
SMILES
CC1=C(C=CC2=C1OC(=O)C3=CC=CC=C23)OCC=C(C)C
InChI
InChI=1S/C19H18O3/c1-12(2)10-11-21-17-9-8-15-14-6-4-5-7-16(14)19(20)22-18(15)13(17)3/h4-10H,11H2,1-3H3
InChIKey
YTCREJZRKBSEGR-UHFFFAOYSA-N
Compound name
4-methyl-3-(3-methylbut-2-enoxy)benzo[c]chromen-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.12558 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.13286 165.9
[M+Na]+ 317.11480 183.1
[M+NH4]+ 312.15940 174.8
[M+K]+ 333.08874 174.5
[M-H]- 293.11830 171.1
[M+Na-2H]- 315.10025 172.8
[M]+ 294.12503 170.2
[M]- 294.12613 170.2
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.