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

2
Patents

274.22968 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.23696 164.3
[M+Na]+ 297.21890 173.4
[M-H]- 273.22240 168.3
[M+NH4]+ 292.26350 188.2
[M+K]+ 313.19284 169.7
[M+H-H2O]+ 257.22694 161.2
[M+HCOO]- 319.22788 181.4
[M+CH3COO]- 333.24353 205.4
[M+Na-2H]- 295.20435 163.6
[M]+ 274.22913 166.8
[M]- 274.23023 166.8
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