CID 131750968

(3xi,6e)-1,7-diphenyl-6-hepten-3-ol

Structural Information

Molecular Formula
C19H22O
SMILES
C1=CC=C(C=C1)CCC(CC/C=C\C2=CC=CC=C2)O
InChI
InChI=1S/C19H22O/c20-19(16-15-18-11-5-2-6-12-18)14-8-7-13-17-9-3-1-4-10-17/h1-7,9-13,19-20H,8,14-16H2/b13-7-
InChIKey
DPRCKWANIKZGTF-QPEQYQDCSA-N
Compound name
(Z)-1,7-diphenylhept-6-en-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

266.16705 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.17433 167.2
[M+Na]+ 289.15627 180.9
[M+NH4]+ 284.20087 175.7
[M+K]+ 305.13021 171.3
[M-H]- 265.15977 171.7
[M+Na-2H]- 287.14172 176.1
[M]+ 266.16650 170.5
[M]- 266.16760 170.5
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