CID 11628

8-fluorooctylamine

Structural Information

Molecular Formula
C8H18FN
SMILES
C(CCCCF)CCCN
InChI
InChI=1S/C8H18FN/c9-7-5-3-1-2-4-6-8-10/h1-8,10H2
InChIKey
NPLDZILAMGNJQI-UHFFFAOYSA-N
Compound name
8-fluorooctan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

147.14233 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.14961 134.7
[M+Na]+ 170.13155 140.2
[M-H]- 146.13505 132.5
[M+NH4]+ 165.17615 155.6
[M+K]+ 186.10549 138.7
[M+H-H2O]+ 130.13959 128.6
[M+HCOO]- 192.14053 157.1
[M+CH3COO]- 206.15618 180.2
[M+Na-2H]- 168.11700 139.3
[M]+ 147.14178 133.7
[M]- 147.14288 133.7
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