CID 65921095

3-[(2,4-difluorophenyl)methyl]azetidin-3-ol hydrochloride

Structural Information

Molecular Formula
C10H11F2NO
SMILES
C1C(CN1)(CC2=C(C=C(C=C2)F)F)O
InChI
InChI=1S/C10H11F2NO/c11-8-2-1-7(9(12)3-8)4-10(14)5-13-6-10/h1-3,13-14H,4-6H2
InChIKey
LDEGUEPGTVITBN-UHFFFAOYSA-N
Compound name
3-[(2,4-difluorophenyl)methyl]azetidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.08087 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.08815 141.3
[M+Na]+ 222.07009 148.9
[M-H]- 198.07359 141.8
[M+NH4]+ 217.11469 153.7
[M+K]+ 238.04403 147.6
[M+H-H2O]+ 182.07813 129.1
[M+HCOO]- 244.07907 157.7
[M+CH3COO]- 258.09472 182.6
[M+Na-2H]- 220.05554 146.0
[M]+ 199.08032 144.5
[M]- 199.08142 144.5
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.