CID 6445317

Triethylamine, 2-(cinnamyloxy)-

Structural Information

Molecular Formula

C₁₅H₂₃NO

SMILES

CCN(CC)CCOC/C=C/C1=CC=CC=C1

InChI

InChI=1S/C15H23NO/c1-3-16(4-2)12-14-17-13-8-11-15-9-6-5-7-10-15/h5-11H,3-4,12-14H2,1-2H3/b11-8+

InChIKey

UTZZQBFESNQSTK-DHZHZOJOSA-N

Compound name

N,N-diethyl-2-[(E)-3-phenylprop-2-enoxy]ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 233.17796 Da
Monoisotopic Mass: 3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	234.185236	158.1
[M+Na]+	256.167178	162.6
[M-H]-	232.170684	162.0
[M+NH4]+	251.211783	176.3
[M+K]+	272.141118	160.4
[M+H-H2O]+	216.175220	150.7
[M+HCOO]-	278.176161	182.7
[M+CH3COO]-	292.191811	198.3
[M+Na-2H]-	254.152626	162.6
[M]+	233.17741142	161.4
[M]-	233.17850858	161.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe