CID 5283290

9s-(2-cyclopentenyl)-1-nonanol

Structural Information

Molecular Formula
C14H26O
SMILES
C1C[C@@H](C=C1)CCCCCCCCCO
InChI
InChI=1S/C14H26O/c15-13-9-5-3-1-2-4-6-10-14-11-7-8-12-14/h7,11,14-15H,1-6,8-10,12-13H2/t14-/m1/s1
InChIKey
RZJXLULHYCLGII-CQSZACIVSA-N
Compound name
9-[(1S)-cyclopent-2-en-1-yl]nonan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.19836 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.20564 155.6
[M+Na]+ 233.18758 159.3
[M-H]- 209.19108 156.2
[M+NH4]+ 228.23218 175.4
[M+K]+ 249.16152 156.1
[M+H-H2O]+ 193.19562 149.4
[M+HCOO]- 255.19656 176.4
[M+CH3COO]- 269.21221 186.4
[M+Na-2H]- 231.17303 157.2
[M]+ 210.19781 156.1
[M]- 210.19891 156.1
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.