CID 63901304

5-methyl-2-(trifluoromethyl)morpholine

Structural Information

Molecular Formula
C6H10F3NO
SMILES
CC1COC(CN1)C(F)(F)F
InChI
InChI=1S/C6H10F3NO/c1-4-3-11-5(2-10-4)6(7,8)9/h4-5,10H,2-3H2,1H3
InChIKey
LUMNOIAAEIAHKT-UHFFFAOYSA-N
Compound name
5-methyl-2-(trifluoromethyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.07144 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.07872 132.6
[M+Na]+ 192.06066 139.3
[M-H]- 168.06416 129.7
[M+NH4]+ 187.10526 149.7
[M+K]+ 208.03460 138.4
[M+H-H2O]+ 152.06870 124.6
[M+HCOO]- 214.06964 145.5
[M+CH3COO]- 228.08529 174.4
[M+Na-2H]- 190.04611 137.9
[M]+ 169.07089 123.9
[M]- 169.07199 123.9
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.