CID 140756

Benzene, 1-hexadecyloxy)-4-methoxy-

Structural Information

Molecular Formula
C23H40O2
SMILES
CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)OC
InChI
InChI=1S/C23H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-25-23-19-17-22(24-2)18-20-23/h17-20H,3-16,21H2,1-2H3
InChIKey
ZRBCTBULZAOUQB-UHFFFAOYSA-N
Compound name
1-hexadecoxy-4-methoxybenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

348.30283 Da
Monoisotopic Mass

9.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.31011 193.3
[M+Na]+ 371.29205 203.9
[M+NH4]+ 366.33665 200.0
[M+K]+ 387.26599 193.6
[M-H]- 347.29555 195.2
[M+Na-2H]- 369.27750 197.2
[M]+ 348.30228 195.3
[M]- 348.30338 195.3
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