CID 126978650

3-bromo-2-[(1-methylpyrrolidin-3-yl)oxy]pyridine

Structural Information

Molecular Formula
C10H13BrN2O
SMILES
CN1CCC(C1)OC2=C(C=CC=N2)Br
InChI
InChI=1S/C10H13BrN2O/c1-13-6-4-8(7-13)14-10-9(11)3-2-5-12-10/h2-3,5,8H,4,6-7H2,1H3
InChIKey
WVLOUPDEILFFES-UHFFFAOYSA-N
Compound name
3-bromo-2-(1-methylpyrrolidin-3-yl)oxypyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.02112 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.028396 149.3
[M+Na]+ 279.010338 160.6
[M-H]- 255.013844 156.0
[M+NH4]+ 274.054943 169.3
[M+K]+ 294.984278 150.2
[M+H-H2O]+ 239.018380 148.1
[M+HCOO]- 301.019321 168.4
[M+CH3COO]- 315.034971 190.2
[M+Na-2H]- 276.995786 154.6
[M]+ 256.02057142 167.0
[M]- 256.02166858 167.0
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.