CID 3056655

Brn 2973544

Structural Information

Molecular Formula
C16H24O
SMILES
CC1CCCCC1C2=CC=C(C=C2)C(C)CO
InChI
InChI=1S/C16H24O/c1-12-5-3-4-6-16(12)15-9-7-14(8-10-15)13(2)11-17/h7-10,12-13,16-17H,3-6,11H2,1-2H3
InChIKey
SYQJNGUVFHQFQY-UHFFFAOYSA-N
Compound name
2-[4-(2-methylcyclohexyl)phenyl]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.18271 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.18999 156.8
[M+Na]+ 255.17193 160.6
[M-H]- 231.17543 161.1
[M+NH4]+ 250.21653 173.9
[M+K]+ 271.14587 157.1
[M+H-H2O]+ 215.17997 150.0
[M+HCOO]- 277.18091 173.9
[M+CH3COO]- 291.19656 191.6
[M+Na-2H]- 253.15738 157.7
[M]+ 232.18216 152.0
[M]- 232.18326 152.0
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.