CID 115011081

1896807-02-5

Structural Information

Molecular Formula
C6H12FN
SMILES
CC1(CC(C1)CN)F
InChI
InChI=1S/C6H12FN/c1-6(7)2-5(3-6)4-8/h5H,2-4,8H2,1H3
InChIKey
AJELTLNLCYNWKN-UHFFFAOYSA-N
Compound name
(3-fluoro-3-methylcyclobutyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

117.095375 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 118.10265 124.1
[M+Na]+ 140.08459 130.6
[M-H]- 116.08810 126.4
[M+NH4]+ 135.12920 141.8
[M+K]+ 156.05853 132.6
[M+H-H2O]+ 100.09264 114.6
[M+HCOO]- 162.09358 145.5
[M+CH3COO]- 176.10923 176.2
[M+Na-2H]- 138.07004 129.7
[M]+ 117.09483 128.8
[M]- 117.09592 128.8
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