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

4
Patents

192.08987 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.09715 141.0
[M+Na]+ 215.07909 149.3
[M-H]- 191.08259 143.2
[M+NH4]+ 210.12369 158.2
[M+K]+ 231.05303 146.7
[M+H-H2O]+ 175.08713 134.5
[M+HCOO]- 237.08807 159.5
[M+CH3COO]- 251.10372 183.6
[M+Na-2H]- 213.06454 147.5
[M]+ 192.08932 138.2
[M]- 192.09042 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