CID 7716

1-phenyldecane

Structural Information

Molecular Formula
C16H26
SMILES
CCCCCCCCCCC1=CC=CC=C1
InChI
InChI=1S/C16H26/c1-2-3-4-5-6-7-8-10-13-16-14-11-9-12-15-16/h9,11-12,14-15H,2-8,10,13H2,1H3
InChIKey
UZILCZKGXMQEQR-UHFFFAOYSA-N
Compound name
decylbenzene
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

4
References

10154
Patents

218.20345 Da
Monoisotopic Mass

7.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.21073 156.1
[M+Na]+ 241.19267 160.5
[M-H]- 217.19617 158.3
[M+NH4]+ 236.23727 174.6
[M+K]+ 257.16661 156.9
[M+H-H2O]+ 201.20071 149.3
[M+HCOO]- 263.20165 178.3
[M+CH3COO]- 277.21730 192.8
[M+Na-2H]- 239.17812 160.5
[M]+ 218.20290 158.5
[M]- 218.20400 158.5
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

No patent data available for this compound.