CID 18427155

Ethanol, 2,2'-((octahydro-4,7-methano-5h-inden-5-ylidene)bis(4,1-phenyleneoxy))bis-

Structural Information

Molecular Formula
C26H32O4
SMILES
C1CC2C(C1)C3CC2CC3(C4=CC=C(C=C4)OCCO)C5=CC=C(C=C5)OCCO
InChI
InChI=1S/C26H32O4/c27-12-14-29-21-8-4-19(5-9-21)26(20-6-10-22(11-7-20)30-15-13-28)17-18-16-25(26)24-3-1-2-23(18)24/h4-11,18,23-25,27-28H,1-3,12-17H2
InChIKey
XOLXPZNXLQIMJN-UHFFFAOYSA-N
Compound name
2-[4-[8-[4-(2-hydroxyethoxy)phenyl]-8-tricyclo[5.2.1.02,6]decanyl]phenoxy]ethanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

32
Patents

408.23007 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 409.23735 200.5
[M+Na]+ 431.21929 204.9
[M-H]- 407.22279 207.8
[M+NH4]+ 426.26389 219.3
[M+K]+ 447.19323 198.7
[M+H-H2O]+ 391.22733 194.7
[M+HCOO]- 453.22827 215.7
[M+CH3COO]- 467.24392 209.0
[M+Na-2H]- 429.20474 197.0
[M]+ 408.22952 201.4
[M]- 408.23062 201.4
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