CID 44955

Ar-41

Structural Information

Molecular Formula
C13H20N2O2
SMILES
CN(C)CCC1=CC=C(C=C1)OC(=O)N(C)C
InChI
InChI=1S/C13H20N2O2/c1-14(2)10-9-11-5-7-12(8-6-11)17-13(16)15(3)4/h5-8H,9-10H2,1-4H3
InChIKey
BPIQXURTVGILMI-UHFFFAOYSA-N
Compound name
[4-[2-(dimethylamino)ethyl]phenyl] N,N-dimethylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

236.15248 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.15976 156.3
[M+Na]+ 259.14170 161.6
[M-H]- 235.14520 162.5
[M+NH4]+ 254.18630 174.9
[M+K]+ 275.11564 162.5
[M+H-H2O]+ 219.14974 148.8
[M+HCOO]- 281.15068 182.3
[M+CH3COO]- 295.16633 204.0
[M+Na-2H]- 257.12715 159.5
[M]+ 236.15193 160.5
[M]- 236.15303 160.5
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.