CID 6444539

2-propenamide, n-(aminocarbonyl)-3-phenyl-

Structural Information

Molecular Formula
C10H10N2O2
SMILES
C1=CC=C(C=C1)/C=C/C(=O)NC(=O)N
InChI
InChI=1S/C10H10N2O2/c11-10(14)12-9(13)7-6-8-4-2-1-3-5-8/h1-7H,(H3,11,12,13,14)/b7-6+
InChIKey
JDVRHVFQVXJPIH-VOTSOKGWSA-N
Compound name
(E)-N-carbamoyl-3-phenylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

190.07423 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.081506 141.3
[M+Na]+ 213.063448 147.0
[M-H]- 189.066954 144.3
[M+NH4]+ 208.108053 159.6
[M+K]+ 229.037388 144.6
[M+H-H2O]+ 173.071490 134.7
[M+HCOO]- 235.072431 166.0
[M+CH3COO]- 249.088081 184.7
[M+Na-2H]- 211.048896 145.9
[M]+ 190.07368142 138.2
[M]- 190.07477858 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

literature stripe

Patent stripe

patents stripe