CID 6449512

125575-18-0

Structural Information

Molecular Formula
C18H29N3O
SMILES
CCCOC1=CC=C(C=C1)/C=C/C(=NCCN(CC)CC)N
InChI
InChI=1S/C18H29N3O/c1-4-15-22-17-10-7-16(8-11-17)9-12-18(19)20-13-14-21(5-2)6-3/h7-12H,4-6,13-15H2,1-3H3,(H2,19,20)/b12-9+
InChIKey
GYWQEJDGGIPKQD-FMIVXFBMSA-N
Compound name
(E)-N'-[2-(diethylamino)ethyl]-3-(4-propoxyphenyl)prop-2-enimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.23105 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.238326 178.9
[M+Na]+ 326.220268 181.7
[M-H]- 302.223774 183.4
[M+NH4]+ 321.264873 194.1
[M+K]+ 342.194208 179.4
[M+H-H2O]+ 286.228310 170.0
[M+HCOO]- 348.229251 204.5
[M+CH3COO]- 362.244901 219.7
[M+Na-2H]- 324.205716 179.8
[M]+ 303.23050142 181.5
[M]- 303.23159858 181.5
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.