CID 22630511

12,12,13,13,14,14,15,15,15-nonafluoropentadecan-1-ol

Structural Information

Molecular Formula
C15H23F9O
SMILES
C(CCCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)CCCCCO
InChI
InChI=1S/C15H23F9O/c16-12(17,13(18,19)14(20,21)15(22,23)24)10-8-6-4-2-1-3-5-7-9-11-25/h25H,1-11H2
InChIKey
SUBCOGZKZCCKOV-UHFFFAOYSA-N
Compound name
12,12,13,13,14,14,15,15,15-nonafluoropentadecan-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

34
Patents

390.16052 Da
Monoisotopic Mass

7.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.16780 187.6
[M+Na]+ 413.14974 192.8
[M-H]- 389.15324 174.3
[M+NH4]+ 408.19434 171.6
[M+K]+ 429.12368 188.0
[M+H-H2O]+ 373.15778 175.4
[M+HCOO]- 435.15872 191.3
[M+CH3COO]- 449.17437 220.1
[M+Na-2H]- 411.13519 187.3
[M]+ 390.15997 177.0
[M]- 390.16107 177.0
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

patents stripe