CID 6446243

(z)-alpha-methyl-alpha-(2-phenylethenyl)-2-pyridinemethanol

Structural Information

Molecular Formula
C15H15NO
SMILES
CC(/C=C\C1=CC=CC=C1)(C2=CC=CC=N2)O
InChI
InChI=1S/C15H15NO/c1-15(17,14-9-5-6-12-16-14)11-10-13-7-3-2-4-8-13/h2-12,17H,1H3/b11-10-
InChIKey
RIBCORSTVFXNDE-KHPPLWFESA-N
Compound name
(Z)-4-phenyl-2-pyridin-2-ylbut-3-en-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.11537 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.12265 152.2
[M+Na]+ 248.10459 158.8
[M-H]- 224.10809 155.8
[M+NH4]+ 243.14919 168.0
[M+K]+ 264.07853 153.9
[M+H-H2O]+ 208.11263 144.6
[M+HCOO]- 270.11357 172.3
[M+CH3COO]- 284.12922 186.0
[M+Na-2H]- 246.09004 160.0
[M]+ 225.11482 150.4
[M]- 225.11592 150.4
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

No patent data available for this compound.