CID 71756931

4-(difluoromethyl)piperidin-4-ol hydrochloride

Structural Information

Molecular Formula
C6H11F2NO
SMILES
C1CNCCC1(C(F)F)O
InChI
InChI=1S/C6H11F2NO/c7-5(8)6(10)1-3-9-4-2-6/h5,9-10H,1-4H2
InChIKey
LEMBJWQAJXGEDK-UHFFFAOYSA-N
Compound name
4-(difluoromethyl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

151.08087 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.08815 130.7
[M+Na]+ 174.07009 136.1
[M-H]- 150.07359 126.9
[M+NH4]+ 169.11469 150.6
[M+K]+ 190.04403 134.1
[M+H-H2O]+ 134.07813 124.0
[M+HCOO]- 196.07907 144.6
[M+CH3COO]- 210.09472 168.6
[M+Na-2H]- 172.05554 135.1
[M]+ 151.08032 120.6
[M]- 151.08142 120.6
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