CID 130487658

3-[(3,3-difluorocyclopentyl)methyl]-3-methylazetidine hydrochloride

Structural Information

Molecular Formula
C10H17F2N
SMILES
CC1(CNC1)CC2CCC(C2)(F)F
InChI
InChI=1S/C10H17F2N/c1-9(6-13-7-9)4-8-2-3-10(11,12)5-8/h8,13H,2-7H2,1H3
InChIKey
YXIVULUEXWUATC-UHFFFAOYSA-N
Compound name
3-[(3,3-difluorocyclopentyl)methyl]-3-methylazetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.1329 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.14018 141.3
[M+Na]+ 212.12212 147.0
[M-H]- 188.12562 142.6
[M+NH4]+ 207.16672 158.1
[M+K]+ 228.09606 146.5
[M+H-H2O]+ 172.13016 130.8
[M+HCOO]- 234.13110 156.9
[M+CH3COO]- 248.14675 182.7
[M+Na-2H]- 210.10757 143.9
[M]+ 189.13235 142.7
[M]- 189.13345 142.7
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

No patent data available for this compound.