CID 23730

Dimethylcarbamic acid o-tolyl ester

Structural Information

Molecular Formula
C10H13NO2
SMILES
CC1=CC=CC=C1OC(=O)N(C)C
InChI
InChI=1S/C10H13NO2/c1-8-6-4-5-7-9(8)13-10(12)11(2)3/h4-7H,1-3H3
InChIKey
QKAVMOJYJHTFPY-UHFFFAOYSA-N
Compound name
(2-methylphenyl) N,N-dimethylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

179.09464 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.10192 138.3
[M+Na]+ 202.08386 150.3
[M+NH4]+ 197.12846 146.7
[M+K]+ 218.05780 144.8
[M-H]- 178.08736 140.9
[M+Na-2H]- 200.06931 145.2
[M]+ 179.09409 140.7
[M]- 179.09519 140.7
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

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