CID 204746

Wv 362

Structural Information

Molecular Formula
C14H24N2O
SMILES
CC1=CC(=C(C=C1N)C(C)C)OCCN(C)C
InChI
InChI=1S/C14H24N2O/c1-10(2)12-9-13(15)11(3)8-14(12)17-7-6-16(4)5/h8-10H,6-7,15H2,1-5H3
InChIKey
XREANCSQIIFTTF-UHFFFAOYSA-N
Compound name
4-[2-(dimethylamino)ethoxy]-2-methyl-5-propan-2-ylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

236.18886 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.19614 158.7
[M+Na]+ 259.17808 164.9
[M-H]- 235.18158 163.4
[M+NH4]+ 254.22268 177.0
[M+K]+ 275.15202 163.9
[M+H-H2O]+ 219.18612 151.8
[M+HCOO]- 281.18706 182.7
[M+CH3COO]- 295.20271 205.5
[M+Na-2H]- 257.16353 159.5
[M]+ 236.18831 161.1
[M]- 236.18941 161.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe