CID 340144

Nsc369983

Structural Information

Molecular Formula
C14H15N3O3
SMILES
CC(=O)NC1=CC2=C(C=CC(=C2)N=CN(C)C)OC1=O
InChI
InChI=1S/C14H15N3O3/c1-9(18)16-12-7-10-6-11(15-8-17(2)3)4-5-13(10)20-14(12)19/h4-8H,1-3H3,(H,16,18)
InChIKey
GWPRGAWTEWNAPC-UHFFFAOYSA-N
Compound name
N-[6-(dimethylaminomethylideneamino)-2-oxochromen-3-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.11133 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.118606 161.3
[M+Na]+ 296.100548 169.3
[M-H]- 272.104054 169.8
[M+NH4]+ 291.145153 178.0
[M+K]+ 312.074488 169.1
[M+H-H2O]+ 256.108590 153.3
[M+HCOO]- 318.109531 188.3
[M+CH3COO]- 332.125181 211.9
[M+Na-2H]- 294.085996 168.3
[M]+ 273.11078142 165.9
[M]- 273.11187858 165.9
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.