CID 171037445

(4r)-3-(4-fluoro-2-hydroxyphenyl)-4-methyl-4,5-dihydro-1h-pyrazole-1-carboximidamide

Structural Information

Molecular Formula
C11H13FN4O
SMILES
C[C@@H]1CN(N=C1C2=C(C=C(C=C2)F)O)C(=N)N
InChI
InChI=1S/C11H13FN4O/c1-6-5-16(11(13)14)15-10(6)8-3-2-7(12)4-9(8)17/h2-4,6,17H,5H2,1H3,(H3,13,14)/t6-/m1/s1
InChIKey
AQXHIDRAVIMBME-ZCFIWIBFSA-N
Compound name
(4R)-5-(4-fluoro-2-hydroxyphenyl)-4-methyl-3,4-dihydropyrazole-2-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.10735 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.11463 152.0
[M+Na]+ 259.09657 161.3
[M+NH4]+ 254.14117 157.7
[M+K]+ 275.07051 158.9
[M-H]- 235.10007 152.8
[M+Na-2H]- 257.08202 156.4
[M]+ 236.10680 153.0
[M]- 236.10790 153.0
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.

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No patent data available for this compound.