CID 621162

93892-40-1

Structural Information

Molecular Formula

C₁₉H₃₀O

SMILES

CC(C)C1=CC2=C(C(=C1O)C(C)C)C(CC2(C)C)(C)C

InChI

InChI=1S/C19H30O/c1-11(2)13-9-14-16(15(12(3)4)17(13)20)19(7,8)10-18(14,5)6/h9,11-12,20H,10H2,1-8H3

InChIKey

WGQDDNQFNLMBOS-UHFFFAOYSA-N

Compound name

1,1,3,3-tetramethyl-4,6-di(propan-2-yl)-2H-inden-5-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 274.22968 Da
Monoisotopic Mass: 6.4
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]+	275.236956	164.3
[M+Na]+	297.218898	173.4
[M-H]-	273.222404	168.3
[M+NH4]+	292.263503	188.2
[M+K]+	313.192838	169.7
[M+H-H2O]+	257.226940	161.2
[M+HCOO]-	319.227881	181.4
[M+CH3COO]-	333.243531	205.4
[M+Na-2H]-	295.204346	163.6
[M]+	274.22913142	166.8
[M]-	274.23022858	166.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe