CID 134816745

Garciosone b

Structural Information

Molecular Formula

C₂₄H₂₄O₅

SMILES

CC1(C=CC2=C3C(=C(C(=C2O1)C(=O)C4=CC(=CC=C4)O)OC)C=CC(O3)(C)C)C

InChI

InChI=1S/C24H24O5/c1-23(2)11-9-16-20(28-23)17-10-12-24(3,4)29-22(17)18(21(16)27-5)19(26)14-7-6-8-15(25)13-14/h6-13,25H,1-5H3

InChIKey

SJYOWQSUTIIWMO-UHFFFAOYSA-N

Compound name

(3-hydroxyphenyl)-(5-methoxy-2,2,8,8-tetramethylpyrano[2,3-h]chromen-6-yl)methanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 392.16238 Da
Monoisotopic Mass: 4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	393.169656	194.0
[M+Na]+	415.151598	203.8
[M-H]-	391.155104	203.2
[M+NH4]+	410.196203	208.3
[M+K]+	431.125538	202.5
[M+H-H2O]+	375.159640	185.1
[M+HCOO]-	437.160581	207.9
[M+CH3COO]-	451.176231	204.6
[M+Na-2H]-	413.137046	198.8
[M]+	392.16183142	199.5
[M]-	392.16292858	199.5

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.