CID 4349685

3256-36-8

Structural Information

Molecular Formula
C11H13N3O2
SMILES
C=CCOC1=CC=C(C=C1)C=NNC(=O)N
InChI
InChI=1S/C11H13N3O2/c1-2-7-16-10-5-3-9(4-6-10)8-13-14-11(12)15/h2-6,8H,1,7H2,(H3,12,14,15)
InChIKey
MVIYCPAKGBXGIO-UHFFFAOYSA-N
Compound name
[(4-prop-2-enoxyphenyl)methylideneamino]urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.10077 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.10805 147.7
[M+Na]+ 242.08999 153.7
[M-H]- 218.09349 152.1
[M+NH4]+ 237.13459 165.5
[M+K]+ 258.06393 151.5
[M+H-H2O]+ 202.09803 140.2
[M+HCOO]- 264.09897 175.6
[M+CH3COO]- 278.11462 196.4
[M+Na-2H]- 240.07544 153.2
[M]+ 219.10022 147.2
[M]- 219.10132 147.2
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.