CID 6365740

Einecs 277-953-6

Structural Information

Molecular Formula
C26H26O2
SMILES
C1=CC=C(C=C1)CC(OC/C=C/C2=CC=CC=C2)OC/C=C/C3=CC=CC=C3
InChI
InChI=1S/C26H26O2/c1-4-12-23(13-5-1)18-10-20-27-26(22-25-16-8-3-9-17-25)28-21-11-19-24-14-6-2-7-15-24/h1-19,26H,20-22H2/b18-10+,19-11+
InChIKey
KYKTVHZQISJUQV-XOBNHNQQSA-N
Compound name
2,2-bis[(E)-3-phenylprop-2-enoxy]ethylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.19327 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.20055 194.5
[M+Na]+ 393.18249 197.3
[M-H]- 369.18599 202.1
[M+NH4]+ 388.22709 205.2
[M+K]+ 409.15643 190.3
[M+H-H2O]+ 353.19053 183.7
[M+HCOO]- 415.19147 215.6
[M+CH3COO]- 429.20712 215.7
[M+Na-2H]- 391.16794 196.9
[M]+ 370.19272 195.2
[M]- 370.19382 195.2
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.