CID 17835

4-methyldecane

Structural Information

Molecular Formula
C11H24
SMILES
CCCCCCC(C)CCC
InChI
InChI=1S/C11H24/c1-4-6-7-8-10-11(3)9-5-2/h11H,4-10H2,1-3H3
InChIKey
DVWZNKLWPILULD-UHFFFAOYSA-N
Compound name
4-methyldecane
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

3
References

1222
Patents

156.1878 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.19508 142.1
[M+Na]+ 179.17702 147.1
[M-H]- 155.18052 141.7
[M+NH4]+ 174.22162 163.5
[M+K]+ 195.15096 146.1
[M+H-H2O]+ 139.18506 137.2
[M+HCOO]- 201.18600 163.3
[M+CH3COO]- 215.20165 183.4
[M+Na-2H]- 177.16247 145.4
[M]+ 156.18725 144.7
[M]- 156.18835 144.7
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

patents stripe