CID 13651614

4-ethyl-4'-propyl-1,1'-biphenyl

Structural Information

Molecular Formula
C17H20
SMILES
CCCC1=CC=C(C=C1)C2=CC=C(C=C2)CC
InChI
InChI=1S/C17H20/c1-3-5-15-8-12-17(13-9-15)16-10-6-14(4-2)7-11-16/h6-13H,3-5H2,1-2H3
InChIKey
JCGYPDKCUMNOCT-UHFFFAOYSA-N
Compound name
1-ethyl-4-(4-propylphenyl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

224.1565 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.16378 152.5
[M+Na]+ 247.14572 159.8
[M-H]- 223.14922 159.1
[M+NH4]+ 242.19032 171.0
[M+K]+ 263.11966 155.2
[M+H-H2O]+ 207.15376 145.2
[M+HCOO]- 269.15470 175.9
[M+CH3COO]- 283.17035 193.4
[M+Na-2H]- 245.13117 157.6
[M]+ 224.15595 153.4
[M]- 224.15705 153.4
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