CID 3024776

P-phenetidine, 3-chloro-beta-(diethylamino)-5-ethoxy-, hydrochloride

Structural Information

Molecular Formula
C14H23ClN2O2
SMILES
CCN(CC)CCOC1=C(C=C(C=C1Cl)N)OCC
InChI
InChI=1S/C14H23ClN2O2/c1-4-17(5-2)7-8-19-14-12(15)9-11(16)10-13(14)18-6-3/h9-10H,4-8,16H2,1-3H3
InChIKey
IPSQZBBDVJEBHA-UHFFFAOYSA-N
Compound name
3-chloro-4-[2-(diethylamino)ethoxy]-5-ethoxyaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

286.1448 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.15208 166.5
[M+Na]+ 309.13402 177.7
[M+NH4]+ 304.17862 174.0
[M+K]+ 325.10796 170.7
[M-H]- 285.13752 169.4
[M+Na-2H]- 307.11947 171.5
[M]+ 286.14425 169.1
[M]- 286.14535 169.1
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.