CID 12223058

(3-phenyl-5,6-dihydro-4h-1,2,4-oxadiazin-6-yl)methanol

Structural Information

Molecular Formula
C10H12N2O2
SMILES
C1C(ONC(=N1)C2=CC=CC=C2)CO
InChI
InChI=1S/C10H12N2O2/c13-7-9-6-11-10(12-14-9)8-4-2-1-3-5-8/h1-5,9,13H,6-7H2,(H,11,12)
InChIKey
CFFSRARAJZRPKG-UHFFFAOYSA-N
Compound name
(3-phenyl-5,6-dihydro-2H-1,2,4-oxadiazin-6-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.08987 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.09715 141.5
[M+Na]+ 215.07909 148.0
[M-H]- 191.08259 143.0
[M+NH4]+ 210.12369 155.2
[M+K]+ 231.05303 145.2
[M+H-H2O]+ 175.08713 133.3
[M+HCOO]- 237.08807 158.2
[M+CH3COO]- 251.10372 152.7
[M+Na-2H]- 213.06454 148.8
[M]+ 192.08932 137.5
[M]- 192.09042 137.5
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.