CID 32761

Brn 3286351

Structural Information

Molecular Formula
C11H16N2O2
SMILES
CC1=C(C=C(C=C1)N(C)C)OC(=O)NC
InChI
InChI=1S/C11H16N2O2/c1-8-5-6-9(13(3)4)7-10(8)15-11(14)12-2/h5-7H,1-4H3,(H,12,14)
InChIKey
XGEFUPITIWOPRD-UHFFFAOYSA-N
Compound name
[5-(dimethylamino)-2-methylphenyl] N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.12119 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.128466 146.6
[M+Na]+ 231.110408 153.5
[M-H]- 207.113914 152.1
[M+NH4]+ 226.155013 166.0
[M+K]+ 247.084348 153.5
[M+H-H2O]+ 191.118450 139.9
[M+HCOO]- 253.119391 172.7
[M+CH3COO]- 267.135041 195.7
[M+Na-2H]- 229.095856 150.8
[M]+ 208.12064142 149.1
[M]- 208.12173858 149.1
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.