CID 126827699

1346216-33-8

Structural Information

Molecular Formula
C11H17N3O
SMILES
CN1C(=CC=N1)C2(C[C@H]3CC[C@@H](C2)N3)O
InChI
InChI=1S/C11H17N3O/c1-14-10(4-5-12-14)11(15)6-8-2-3-9(7-11)13-8/h4-5,8-9,13,15H,2-3,6-7H2,1H3/t8-,9+,11?
InChIKey
SDXRTBLFMFMZQS-SLHIUPAKSA-N
Compound name
(1R,5S)-3-(2-methylpyrazol-3-yl)-8-azabicyclo[3.2.1]octan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.13716 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.14444 148.3
[M+Na]+ 230.12638 155.7
[M-H]- 206.12988 147.9
[M+NH4]+ 225.17098 168.9
[M+K]+ 246.10032 151.8
[M+H-H2O]+ 190.13442 141.1
[M+HCOO]- 252.13536 162.5
[M+CH3COO]- 266.15101 159.1
[M+Na-2H]- 228.11183 150.8
[M]+ 207.13661 143.5
[M]- 207.13771 143.5
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.