CID 74009602

Pechvch-meop

Structural Information

Molecular Formula
C24H34O
SMILES
CC=CC1CCC(CC1)C=CC2CCC(CC2)C3=CC=C(C=C3)OC
InChI
InChI=1S/C24H34O/c1-3-4-19-5-7-20(8-6-19)9-10-21-11-13-22(14-12-21)23-15-17-24(25-2)18-16-23/h3-4,9-10,15-22H,5-8,11-14H2,1-2H3
InChIKey
KNQWLMDEPOJMOJ-UHFFFAOYSA-N
Compound name
1-methoxy-4-[4-[2-(4-prop-1-enylcyclohexyl)ethenyl]cyclohexyl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

338.26096 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.26824 188.0
[M+Na]+ 361.25018 188.8
[M-H]- 337.25368 194.9
[M+NH4]+ 356.29478 200.8
[M+K]+ 377.22412 182.5
[M+H-H2O]+ 321.25822 178.4
[M+HCOO]- 383.25916 202.2
[M+CH3COO]- 397.27481 212.6
[M+Na-2H]- 359.23563 184.7
[M]+ 338.26041 180.1
[M]- 338.26151 180.1
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