CID 50033

2-(dimethylamino)ethyl n-(2-methoxyphenyl)carbamate

Structural Information

Molecular Formula
C12H18N2O3
SMILES
CN(C)CCOC(=O)NC1=CC=CC=C1OC
InChI
InChI=1S/C12H18N2O3/c1-14(2)8-9-17-12(15)13-10-6-4-5-7-11(10)16-3/h4-7H,8-9H2,1-3H3,(H,13,15)
InChIKey
BCRUKIRKEVXOOW-UHFFFAOYSA-N
Compound name
2-(dimethylamino)ethyl N-(2-methoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

0
Patents

238.13174 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.13902 154.5
[M+Na]+ 261.12096 159.9
[M-H]- 237.12446 159.3
[M+NH4]+ 256.16556 172.2
[M+K]+ 277.09490 160.1
[M+H-H2O]+ 221.12900 147.0
[M+HCOO]- 283.12994 180.5
[M+CH3COO]- 297.14559 199.6
[M+Na-2H]- 259.10641 158.9
[M]+ 238.13119 158.4
[M]- 238.13229 158.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.