CID 3075009

171011-13-5

Structural Information

Molecular Formula
C18H21N3O2
SMILES
COC1=CC=C(C=C1)N=C(C2=C(N=C3CCCCC3=C2)OC)N
InChI
InChI=1S/C18H21N3O2/c1-22-14-9-7-13(8-10-14)20-17(19)15-11-12-5-3-4-6-16(12)21-18(15)23-2/h7-11H,3-6H2,1-2H3,(H2,19,20)
InChIKey
UWZWPWBLKAMUBP-UHFFFAOYSA-N
Compound name
2-methoxy-N'-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinoline-3-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.1634 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.17068 173.1
[M+Na]+ 334.15262 178.6
[M-H]- 310.15612 179.5
[M+NH4]+ 329.19722 186.9
[M+K]+ 350.12656 174.9
[M+H-H2O]+ 294.16066 163.2
[M+HCOO]- 356.16160 194.1
[M+CH3COO]- 370.17725 213.9
[M+Na-2H]- 332.13807 177.4
[M]+ 311.16285 172.0
[M]- 311.16395 172.0
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.