CID 275163

Dicyclohexyl-phenyl-methanol

Structural Information

Molecular Formula
C19H28O
SMILES
C1CCC(CC1)C(C2CCCCC2)(C3=CC=CC=C3)O
InChI
InChI=1S/C19H28O/c20-19(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1,4-5,10-11,17-18,20H,2-3,6-9,12-15H2
InChIKey
DHEFEZRVDYNNFC-UHFFFAOYSA-N
Compound name
dicyclohexyl(phenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

272.21402 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.22130 167.3
[M+Na]+ 295.20324 166.7
[M-H]- 271.20674 172.8
[M+NH4]+ 290.24784 181.3
[M+K]+ 311.17718 162.3
[M+H-H2O]+ 255.21128 159.0
[M+HCOO]- 317.21222 179.8
[M+CH3COO]- 331.22787 195.0
[M+Na-2H]- 293.18869 169.3
[M]+ 272.21347 155.9
[M]- 272.21457 155.9
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