CID 2103990

1049754-73-5

Structural Information

Molecular Formula
C15H26N2O2
SMILES
CCOC1=C(C=C(C=C1)CNCCCN(C)C)OC
InChI
InChI=1S/C15H26N2O2/c1-5-19-14-8-7-13(11-15(14)18-4)12-16-9-6-10-17(2)3/h7-8,11,16H,5-6,9-10,12H2,1-4H3
InChIKey
SPEVNBMRJHSFCN-UHFFFAOYSA-N
Compound name
N-[(4-ethoxy-3-methoxyphenyl)methyl]-N',N'-dimethylpropane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.19943 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.20671 165.6
[M+Na]+ 289.18865 170.6
[M-H]- 265.19215 170.1
[M+NH4]+ 284.23325 182.6
[M+K]+ 305.16259 169.6
[M+H-H2O]+ 249.19669 157.8
[M+HCOO]- 311.19763 191.1
[M+CH3COO]- 325.21328 209.1
[M+Na-2H]- 287.17410 168.9
[M]+ 266.19888 171.1
[M]- 266.19998 171.1
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.