CID 2436429

(e)-3,4-dihydro-2-((1,1'-biphenyl)-4-ylmethylene)-1(2h)-naphthalenone

Structural Information

Molecular Formula
C23H18O
SMILES
C1C/C(=C\C2=CC=C(C=C2)C3=CC=CC=C3)/C(=O)C4=CC=CC=C41
InChI
InChI=1S/C23H18O/c24-23-21(15-14-20-8-4-5-9-22(20)23)16-17-10-12-19(13-11-17)18-6-2-1-3-7-18/h1-13,16H,14-15H2/b21-16+
InChIKey
JVAMMZBJUMLXEZ-LTGZKZEYSA-N
Compound name
(2E)-2-[(4-phenylphenyl)methylidene]-3,4-dihydronaphthalen-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

310.13577 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.14305 174.4
[M+Na]+ 333.12499 181.0
[M-H]- 309.12849 184.1
[M+NH4]+ 328.16959 189.2
[M+K]+ 349.09893 173.5
[M+H-H2O]+ 293.13303 164.5
[M+HCOO]- 355.13397 194.2
[M+CH3COO]- 369.14962 185.0
[M+Na-2H]- 331.11044 178.6
[M]+ 310.13522 170.4
[M]- 310.13632 170.4
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

No patent data available for this compound.