CID 46122

63982-49-0

Structural Information

Molecular Formula
C12H18N2O2
SMILES
CC1=CC(=C(C=C1N(C)C)OC(=O)NC)C
InChI
InChI=1S/C12H18N2O2/c1-8-6-9(2)11(16-12(15)13-3)7-10(8)14(4)5/h6-7H,1-5H3,(H,13,15)
InChIKey
GFLXVHGIEFTDLZ-UHFFFAOYSA-N
Compound name
[5-(dimethylamino)-2,4-dimethylphenyl] N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.13683 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.144106 150.7
[M+Na]+ 245.126048 158.2
[M-H]- 221.129554 156.4
[M+NH4]+ 240.170653 169.9
[M+K]+ 261.099988 158.0
[M+H-H2O]+ 205.134090 144.1
[M+HCOO]- 267.135031 176.5
[M+CH3COO]- 281.150681 199.9
[M+Na-2H]- 243.111496 153.8
[M]+ 222.13628142 154.0
[M]- 222.13737858 154.0
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.