CID 343993

7467-17-6

Structural Information

Molecular Formula
C14H17N3O3
SMILES
CCOC1=CC(=NNC2=CC=C(C=C2)[N+](=O)[O-])CCC1
InChI
InChI=1S/C14H17N3O3/c1-2-20-14-5-3-4-12(10-14)16-15-11-6-8-13(9-7-11)17(18)19/h6-10,15H,2-5H2,1H3
InChIKey
OWHSVAANAHWCAK-UHFFFAOYSA-N
Compound name
N-[(3-ethoxycyclohex-2-en-1-ylidene)amino]-4-nitroaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.12698 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.13426 161.7
[M+Na]+ 298.11620 173.5
[M+NH4]+ 293.16080 169.4
[M+K]+ 314.09014 169.0
[M-H]- 274.11970 168.1
[M+Na-2H]- 296.10165 169.3
[M]+ 275.12643 164.8
[M]- 275.12753 164.8
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.