CID 10728075

4-methyltetradecan-7-ol

Structural Information

Molecular Formula
C15H32O
SMILES
CCCCCCCC(CCC(C)CCC)O
InChI
InChI=1S/C15H32O/c1-4-6-7-8-9-11-15(16)13-12-14(3)10-5-2/h14-16H,4-13H2,1-3H3
InChIKey
SVAGMMFIDBCZJL-UHFFFAOYSA-N
Compound name
4-methyltetradecan-7-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

228.24532 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.25260 165.1
[M+Na]+ 251.23454 167.7
[M-H]- 227.23804 162.5
[M+NH4]+ 246.27914 182.7
[M+K]+ 267.20848 165.6
[M+H-H2O]+ 211.24258 159.4
[M+HCOO]- 273.24352 182.7
[M+CH3COO]- 287.25917 195.3
[M+Na-2H]- 249.21999 164.2
[M]+ 228.24477 168.0
[M]- 228.24587 168.0
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

patents stripe