CID 21320039

(1,3,4-oxadiazol-2-yl)methanol

Structural Information

Molecular Formula

C₃H₄N₂O₂

SMILES

C1=NN=C(O1)CO

InChI

InChI=1S/C3H4N2O2/c6-1-3-5-4-2-7-3/h2,6H,1H2

InChIKey

XRVNVDTWWMOZCA-UHFFFAOYSA-N

Compound name

1,3,4-oxadiazol-2-ylmethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 242
Patents: 100.027275 Da
Monoisotopic Mass: -1.1
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]+	101.03455	114.7
[M+Na]+	123.01649	126.3
[M+NH4]+	118.06110	122.3
[M+K]+	138.99043	124.1
[M-H]-	99.019999	115.4
[M+Na-2H]-	121.00194	120.2
[M]+	100.02673	116.3
[M]-	100.02782	116.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe