CID 5385733

Dtxsid50430454

Structural Information

Molecular Formula
C10H12N2O
SMILES
CC1=CC=C(C=C1)/C=N\NC(=O)C
InChI
InChI=1S/C10H12N2O/c1-8-3-5-10(6-4-8)7-11-12-9(2)13/h3-7H,1-2H3,(H,12,13)/b11-7-
InChIKey
OTXOLASULYVVKB-XFFZJAGNSA-N
Compound name
N-[(Z)-(4-methylphenyl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

176.09496 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.10224 137.4
[M+Na]+ 199.08418 144.5
[M-H]- 175.08768 142.7
[M+NH4]+ 194.12878 157.9
[M+K]+ 215.05812 143.0
[M+H-H2O]+ 159.09222 130.9
[M+HCOO]- 221.09316 164.9
[M+CH3COO]- 235.10881 187.6
[M+Na-2H]- 197.06963 144.2
[M]+ 176.09441 137.7
[M]- 176.09551 137.7
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