CID 131147691

1936355-29-1

Structural Information

Molecular Formula
C7H8N2O2
SMILES
C1CC2=C(C(=O)C1)N=C(O2)N
InChI
InChI=1S/C7H8N2O2/c8-7-9-6-4(10)2-1-3-5(6)11-7/h1-3H2,(H2,8,9)
InChIKey
WACJDTYTFXSMIN-UHFFFAOYSA-N
Compound name
2-amino-6,7-dihydro-5H-1,3-benzoxazol-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.05858 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.06586 128.4
[M+Na]+ 175.04780 139.3
[M+NH4]+ 170.09240 136.9
[M+K]+ 191.02174 136.5
[M-H]- 151.05130 131.1
[M+Na-2H]- 173.03325 132.3
[M]+ 152.05803 130.4
[M]- 152.05913 130.4
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.