CID 122164220

Rac-(2r,3r)-2-[1-(cyclopropylmethyl)-1h-pyrazol-5-yl]oxolan-3-amine dihydrochloride

Structural Information

Molecular Formula
C11H17N3O
SMILES
C1CO[C@H]([C@@H]1N)C2=CC=NN2CC3CC3
InChI
InChI=1S/C11H17N3O/c12-9-4-6-15-11(9)10-3-5-13-14(10)7-8-1-2-8/h3,5,8-9,11H,1-2,4,6-7,12H2/t9-,11-/m1/s1
InChIKey
FPVNXBNJCSHELP-MWLCHTKSSA-N
Compound name
(2R,3R)-2-[2-(cyclopropylmethyl)pyrazol-3-yl]oxolan-3-amine
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 145.8
[M+Na]+ 230.12638 154.5
[M-H]- 206.12988 153.8
[M+NH4]+ 225.17098 158.9
[M+K]+ 246.10032 151.6
[M+H-H2O]+ 190.13442 138.1
[M+HCOO]- 252.13536 167.1
[M+CH3COO]- 266.15101 158.1
[M+Na-2H]- 228.11183 147.5
[M]+ 207.13661 146.0
[M]- 207.13771 146.0
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.