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]+ 223.14411 150.7
[M+Na]+ 245.12605 158.2
[M-H]- 221.12955 156.4
[M+NH4]+ 240.17065 169.9
[M+K]+ 261.09999 158.0
[M+H-H2O]+ 205.13409 144.1
[M+HCOO]- 267.13503 176.5
[M+CH3COO]- 281.15068 199.9
[M+Na-2H]- 243.11150 153.8
[M]+ 222.13628 154.0
[M]- 222.13738 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.