CID 44951

63884-69-5

Structural Information

Molecular Formula
C13H20N2O2
SMILES
CCC1=CC(=C(C=C1)OC(=O)N(C)C)N(C)C
InChI
InChI=1S/C13H20N2O2/c1-6-10-7-8-12(11(9-10)14(2)3)17-13(16)15(4)5/h7-9H,6H2,1-5H3
InChIKey
HRJJQOVAKFAZHV-UHFFFAOYSA-N
Compound name
[2-(dimethylamino)-4-ethylphenyl] N,N-dimethylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

236.15248 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.159756 155.6
[M+Na]+ 259.141698 161.9
[M-H]- 235.145204 162.2
[M+NH4]+ 254.186303 174.5
[M+K]+ 275.115638 162.8
[M+H-H2O]+ 219.149740 148.4
[M+HCOO]- 281.150681 181.6
[M+CH3COO]- 295.166331 205.2
[M+Na-2H]- 257.127146 158.1
[M]+ 236.15193142 160.1
[M]- 236.15302858 160.1
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.