CID 2848079

Triethylamine, 2-(mesityloxy)-

Structural Information

Molecular Formula
C15H25NO
SMILES
CCN(CC)CCOC1=C(C=C(C=C1C)C)C
InChI
InChI=1S/C15H25NO/c1-6-16(7-2)8-9-17-15-13(4)10-12(3)11-14(15)5/h10-11H,6-9H2,1-5H3
InChIKey
PXBXFMYMLDAWMU-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-(2,4,6-trimethylphenoxy)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

235.19362 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.20090 157.5
[M+Na]+ 258.18284 164.5
[M-H]- 234.18634 162.6
[M+NH4]+ 253.22744 176.7
[M+K]+ 274.15678 163.1
[M+H-H2O]+ 218.19088 150.8
[M+HCOO]- 280.19182 181.8
[M+CH3COO]- 294.20747 203.3
[M+Na-2H]- 256.16829 160.0
[M]+ 235.19307 162.8
[M]- 235.19417 162.8
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.