CID 23594

4-allyloxy-n,n,3,5-tetraethylbenzylamine hydrochloride

Structural Information

Molecular Formula
C18H29NO
SMILES
CCC1=CC(=CC(=C1OCC=C)CC)CN(CC)CC
InChI
InChI=1S/C18H29NO/c1-6-11-20-18-16(7-2)12-15(13-17(18)8-3)14-19(9-4)10-5/h6,12-13H,1,7-11,14H2,2-5H3
InChIKey
YJOGVWAMWAIKQR-UHFFFAOYSA-N
Compound name
N-[(3,5-diethyl-4-prop-2-enoxyphenyl)methyl]-N-ethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.2249 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.23218 170.3
[M+Na]+ 298.21412 182.1
[M+NH4]+ 293.25872 177.9
[M+K]+ 314.18806 173.8
[M-H]- 274.21762 173.4
[M+Na-2H]- 296.19957 175.4
[M]+ 275.22435 172.8
[M]- 275.22545 172.8
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.