CID 28008

16720-01-7

Structural Information

Molecular Formula
C15H14O3
SMILES
CC1(C2=CC=CC=C2C3=C(C=C(C=C3O1)O)O)C
InChI
InChI=1S/C15H14O3/c1-15(2)11-6-4-3-5-10(11)14-12(17)7-9(16)8-13(14)18-15/h3-8,16-17H,1-2H3
InChIKey
YWPDGABYTMCJDP-UHFFFAOYSA-N
Compound name
6,6-dimethylbenzo[c]chromene-1,3-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.0943 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.101576 152.1
[M+Na]+ 265.083518 162.6
[M-H]- 241.087024 156.6
[M+NH4]+ 260.128123 171.8
[M+K]+ 281.057458 159.3
[M+H-H2O]+ 225.091560 146.2
[M+HCOO]- 287.092501 169.5
[M+CH3COO]- 301.108151 165.0
[M+Na-2H]- 263.068966 160.7
[M]+ 242.09375142 153.5
[M]- 242.09484858 153.5
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.