CID 20284

N-pentylcyclohexane

Structural Information

Molecular Formula
C11H22
SMILES
CCCCCC1CCCCC1
InChI
InChI=1S/C11H22/c1-2-3-5-8-11-9-6-4-7-10-11/h11H,2-10H2,1H3
InChIKey
HLTMUYBTNSVOFY-UHFFFAOYSA-N
Compound name
pentylcyclohexane
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

2254
Patents

154.17215 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.17943 138.7
[M+Na]+ 177.16137 149.6
[M+NH4]+ 172.20597 148.5
[M+K]+ 193.13531 141.5
[M-H]- 153.16487 141.6
[M+Na-2H]- 175.14682 144.3
[M]+ 154.17160 141.0
[M]- 154.17270 141.0
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

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