CID 37263

35793-87-4

Structural Information

Molecular Formula
C10H12N2O2
SMILES
CCC1NC(=O)C2=C(O1)C=CC(=C2)N
InChI
InChI=1S/C10H12N2O2/c1-2-9-12-10(13)7-5-6(11)3-4-8(7)14-9/h3-5,9H,2,11H2,1H3,(H,12,13)
InChIKey
KFXTUQBOKKTTEP-UHFFFAOYSA-N
Compound name
6-amino-2-ethyl-2,3-dihydro-1,3-benzoxazin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

192.08987 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.097146 141.0
[M+Na]+ 215.079088 149.3
[M-H]- 191.082594 143.2
[M+NH4]+ 210.123693 158.2
[M+K]+ 231.053028 146.7
[M+H-H2O]+ 175.087130 134.5
[M+HCOO]- 237.088071 159.5
[M+CH3COO]- 251.103721 183.6
[M+Na-2H]- 213.064536 147.5
[M]+ 192.08932142 138.2
[M]- 192.09041858 138.2
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

patents stripe