CID 25240035

Nonacosan-10-ol

Structural Information

Molecular Formula
C29H60O
SMILES
CCCCCCCCCCCCCCCCCCCC(CCCCCCCCC)O
InChI
InChI=1S/C29H60O/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-22-24-26-28-29(30)27-25-23-21-10-8-6-4-2/h29-30H,3-28H2,1-2H3
InChIKey
CPGCVOVWHCWVTP-UHFFFAOYSA-N
Compound name
nonacosan-10-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

14
References

256
Patents

424.46442 Da
Monoisotopic Mass

14.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 425.47170 222.9
[M+Na]+ 447.45364 228.4
[M+NH4]+ 442.49824 226.2
[M+K]+ 463.42758 217.6
[M-H]- 423.45714 221.3
[M+Na-2H]- 445.43909 220.6
[M]+ 424.46387 222.9
[M]- 424.46497 222.9
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