CID 4201093

4,5-dimethyl-2-(2,4,4,6,7-pentamethylchroman-2-yl)phenol

Structural Information

Molecular Formula
C22H28O2
SMILES
CC1=CC(=C(C=C1C)O)C2(CC(C3=C(O2)C=C(C(=C3)C)C)(C)C)C
InChI
InChI=1S/C22H28O2/c1-13-8-17(19(23)10-15(13)3)22(7)12-21(5,6)18-9-14(2)16(4)11-20(18)24-22/h8-11,23H,12H2,1-7H3
InChIKey
BWUCXHNBJWCFDR-UHFFFAOYSA-N
Compound name
4,5-dimethyl-2-(2,4,4,6,7-pentamethyl-3H-chromen-2-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.20892 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.21620 177.5
[M+Na]+ 347.19814 193.8
[M+NH4]+ 342.24274 189.4
[M+K]+ 363.17208 181.8
[M-H]- 323.20164 184.5
[M+Na-2H]- 345.18359 186.6
[M]+ 324.20837 182.6
[M]- 324.20947 182.6
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.