CID 36660

Deboxamet

Structural Information

Molecular Formula
C12H14N2O3
SMILES
CC1=C(C2=C(N1)C=CC(=C2)OC)CC(=O)NO
InChI
InChI=1S/C12H14N2O3/c1-7-9(6-12(15)14-16)10-5-8(17-2)3-4-11(10)13-7/h3-5,13,16H,6H2,1-2H3,(H,14,15)
InChIKey
VXMGLMHPFWGAJO-UHFFFAOYSA-N
Compound name
N-hydroxy-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

1088
Patents

234.10045 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.107726 150.2
[M+Na]+ 257.089668 159.5
[M-H]- 233.093174 151.8
[M+NH4]+ 252.134273 168.5
[M+K]+ 273.063608 155.7
[M+H-H2O]+ 217.097710 144.0
[M+HCOO]- 279.098651 172.4
[M+CH3COO]- 293.114301 189.1
[M+Na-2H]- 255.075116 154.8
[M]+ 234.09990142 152.3
[M]- 234.10099858 152.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe