CID 165891377

1-(4-fluoro-1-{[2-(trimethylsilyl)ethoxy]methyl}-1h-pyrazol-5-yl)methanamine

Structural Information

Molecular Formula
C10H20FN3OSi
SMILES
C[Si](C)(C)CCOCN1C(=C(C=N1)F)CN
InChI
InChI=1S/C10H20FN3OSi/c1-16(2,3)5-4-15-8-14-10(6-12)9(11)7-13-14/h7H,4-6,8,12H2,1-3H3
InChIKey
QIYGDHIJRGKANV-UHFFFAOYSA-N
Compound name
[4-fluoro-2-(2-trimethylsilylethoxymethyl)pyrazol-3-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

245.13597 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.14325 155.8
[M+Na]+ 268.12519 163.5
[M-H]- 244.12869 154.9
[M+NH4]+ 263.16979 172.9
[M+K]+ 284.09913 161.2
[M+H-H2O]+ 228.13323 147.6
[M+HCOO]- 290.13417 175.6
[M+CH3COO]- 304.14982 194.5
[M+Na-2H]- 266.11064 158.5
[M]+ 245.13542 156.9
[M]- 245.13652 156.9
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.