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]+ 274.11861 161.3
[M+Na]+ 296.10055 169.3
[M-H]- 272.10405 169.8
[M+NH4]+ 291.14515 178.0
[M+K]+ 312.07449 169.1
[M+H-H2O]+ 256.10859 153.3
[M+HCOO]- 318.10953 188.3
[M+CH3COO]- 332.12518 211.9
[M+Na-2H]- 294.08600 168.3
[M]+ 273.11078 165.9
[M]- 273.11188 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.