CID 63898672

2770358-77-3

Structural Information

Molecular Formula
C6H11F3N2
SMILES
CN1CCC(C1)(C(F)(F)F)N
InChI
InChI=1S/C6H11F3N2/c1-11-3-2-5(10,4-11)6(7,8)9/h2-4,10H2,1H3
InChIKey
YXNGKJWUKQEZIU-UHFFFAOYSA-N
Compound name
1-methyl-3-(trifluoromethyl)pyrrolidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

168.08743 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.09471 130.8
[M+Na]+ 191.07665 138.9
[M-H]- 167.08015 128.8
[M+NH4]+ 186.12125 153.3
[M+K]+ 207.05059 137.3
[M+H-H2O]+ 151.08469 123.6
[M+HCOO]- 213.08563 148.5
[M+CH3COO]- 227.10128 178.5
[M+Na-2H]- 189.06210 135.1
[M]+ 168.08688 122.6
[M]- 168.08798 122.6
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