CID 71343858

1,11-diphenoxyundecane

Structural Information

Molecular Formula
C23H32O2
SMILES
C1=CC=C(C=C1)OCCCCCCCCCCCOC2=CC=CC=C2
InChI
InChI=1S/C23H32O2/c1(2-4-6-14-20-24-22-16-10-8-11-17-22)3-5-7-15-21-25-23-18-12-9-13-19-23/h8-13,16-19H,1-7,14-15,20-21H2
InChIKey
ZPWUBAJYGXZRQA-UHFFFAOYSA-N
Compound name
11-phenoxyundecoxybenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

340.24023 Da
Monoisotopic Mass

7.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 341.24751 188.8
[M+Na]+ 363.22945 202.0
[M+NH4]+ 358.27405 196.8
[M+K]+ 379.20339 191.0
[M-H]- 339.23295 193.6
[M+Na-2H]- 361.21490 197.2
[M]+ 340.23968 192.2
[M]- 340.24078 192.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe