CID 9614

7-fluoroheptylamine

Structural Information

Molecular Formula
C7H16FN
SMILES
C(CCCN)CCCF
InChI
InChI=1S/C7H16FN/c8-6-4-2-1-3-5-7-9/h1-7,9H2
InChIKey
UUQQOJIPZZOPGZ-UHFFFAOYSA-N
Compound name
7-fluoroheptan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

133.12668 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.133956 130.1
[M+Na]+ 156.115898 136.0
[M-H]- 132.119404 128.1
[M+NH4]+ 151.160503 151.6
[M+K]+ 172.089838 134.8
[M+H-H2O]+ 116.123940 124.2
[M+HCOO]- 178.124881 152.9
[M+CH3COO]- 192.140531 177.1
[M+Na-2H]- 154.101346 135.2
[M]+ 133.12613142 128.7
[M]- 133.12722858 128.7
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