CID 6454223

4,4'-decylidenebisphenol

Structural Information

Molecular Formula
C22H30O2
SMILES
CCCCCCCCCC(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O
InChI
InChI=1S/C22H30O2/c1-2-3-4-5-6-7-8-9-22(18-10-14-20(23)15-11-18)19-12-16-21(24)17-13-19/h10-17,22-24H,2-9H2,1H3
InChIKey
ICYDRUIZSPKQOH-UHFFFAOYSA-N
Compound name
4-[1-(4-hydroxyphenyl)decyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3464
Patents

326.22458 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.23186 183.6
[M+Na]+ 349.21380 187.3
[M-H]- 325.21730 186.4
[M+NH4]+ 344.25840 196.2
[M+K]+ 365.18774 181.4
[M+H-H2O]+ 309.22184 175.4
[M+HCOO]- 371.22278 201.6
[M+CH3COO]- 385.23843 208.0
[M+Na-2H]- 347.19925 183.7
[M]+ 326.22403 184.7
[M]- 326.22513 184.7
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