CID 374759

Nsc653003

Structural Information

Molecular Formula
C23H24O4
SMILES
CC1(CCC2=CC3=C(C(=C2O1)OC)OC(=O)C=C3CCC4=CC=CC=C4)C
InChI
InChI=1S/C23H24O4/c1-23(2)12-11-17-13-18-16(10-9-15-7-5-4-6-8-15)14-19(24)26-21(18)22(25-3)20(17)27-23/h4-8,13-14H,9-12H2,1-3H3
InChIKey
SLCCJFVICRGOKF-UHFFFAOYSA-N
Compound name
10-methoxy-2,2-dimethyl-6-(2-phenylethyl)-3,4-dihydropyrano[3,2-g]chromen-8-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

364.16745 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.17473 188.0
[M+Na]+ 387.15667 197.2
[M-H]- 363.16017 197.9
[M+NH4]+ 382.20127 202.0
[M+K]+ 403.13061 194.9
[M+H-H2O]+ 347.16471 178.3
[M+HCOO]- 409.16565 204.6
[M+CH3COO]- 423.18130 199.1
[M+Na-2H]- 385.14212 193.8
[M]+ 364.16690 192.9
[M]- 364.16800 192.9
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

patents stripe