CID 24255089

2243509-32-0

Structural Information

Molecular Formula

C₇H₁₂N₄O

SMILES

C1CCN(C1)C2=NN=C(O2)CN

InChI

InChI=1S/C7H12N4O/c8-5-6-9-10-7(12-6)11-3-1-2-4-11/h1-5,8H2

InChIKey

PBDIXBLXGSHDKP-UHFFFAOYSA-N

Compound name

(5-pyrrolidin-1-yl-1,3,4-oxadiazol-2-yl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 168.1011 Da
Monoisotopic Mass: -0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	169.10838	134.9
[M+Na]+	191.09032	144.4
[M+NH4]+	186.13492	142.1
[M+K]+	207.06426	144.0
[M-H]-	167.09382	137.3
[M+Na-2H]-	189.07577	139.6
[M]+	168.10055	136.5
[M]-	168.10165	136.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.