CID 458190

2'-hydroxy-2,4,5',6-tetramethylbenzophenone

Structural Information

Molecular Formula
C17H18O2
SMILES
CC1=CC(=C(C=C1)O)C(=O)C2=C(C=C(C=C2C)C)C
InChI
InChI=1S/C17H18O2/c1-10-5-6-15(18)14(9-10)17(19)16-12(3)7-11(2)8-13(16)4/h5-9,18H,1-4H3
InChIKey
UIVHMIWDOUXNAL-UHFFFAOYSA-N
Compound name
(2-hydroxy-5-methylphenyl)-(2,4,6-trimethylphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.13068 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.13796 156.8
[M+Na]+ 277.11990 166.3
[M-H]- 253.12340 163.4
[M+NH4]+ 272.16450 174.1
[M+K]+ 293.09384 162.2
[M+H-H2O]+ 237.12794 150.3
[M+HCOO]- 299.12888 178.3
[M+CH3COO]- 313.14453 198.5
[M+Na-2H]- 275.10535 158.2
[M]+ 254.13013 158.7
[M]- 254.13123 158.7
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.