CID 2794206

2-(2,4-dimethylphenoxy)ethanamine

Structural Information

Molecular Formula
C10H15NO
SMILES
CC1=CC(=C(C=C1)OCCN)C
InChI
InChI=1S/C10H15NO/c1-8-3-4-10(9(2)7-8)12-6-5-11/h3-4,7H,5-6,11H2,1-2H3
InChIKey
WTMWXJLUFMRFBV-UHFFFAOYSA-N
Compound name
2-(2,4-dimethylphenoxy)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

165.11537 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.122646 135.6
[M+Na]+ 188.104588 143.6
[M-H]- 164.108094 139.2
[M+NH4]+ 183.149193 156.3
[M+K]+ 204.078528 141.6
[M+H-H2O]+ 148.112630 129.9
[M+HCOO]- 210.113571 160.5
[M+CH3COO]- 224.129221 182.8
[M+Na-2H]- 186.090036 141.1
[M]+ 165.11482142 136.3
[M]- 165.11591858 136.3
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

patents stripe