CID 274347

Ethyl 2-(2-phenylhydrazinylidene)propanoate

Structural Information

Molecular Formula
C11H14N2O2
SMILES
CCOC(=O)C(=NNC1=CC=CC=C1)C
InChI
InChI=1S/C11H14N2O2/c1-3-15-11(14)9(2)12-13-10-7-5-4-6-8-10/h4-8,13H,3H2,1-2H3
InChIKey
NRHLGLQBPHEKMF-UHFFFAOYSA-N
Compound name
ethyl 2-(phenylhydrazinylidene)propanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

8
Patents

206.10553 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.11281 146.0
[M+Na]+ 229.09475 151.3
[M-H]- 205.09825 150.7
[M+NH4]+ 224.13935 164.8
[M+K]+ 245.06869 150.6
[M+H-H2O]+ 189.10279 138.8
[M+HCOO]- 251.10373 172.4
[M+CH3COO]- 265.11938 192.4
[M+Na-2H]- 227.08020 151.7
[M]+ 206.10498 147.0
[M]- 206.10608 147.0
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