CID 75135

2184-77-2

Structural Information

Molecular Formula
C14H20N2O3
SMILES
CC1=CC(=CC(=C1N(C)C)C)OC(=O)NCC(=O)C
InChI
InChI=1S/C14H20N2O3/c1-9-6-12(7-10(2)13(9)16(4)5)19-14(18)15-8-11(3)17/h6-7H,8H2,1-5H3,(H,15,18)
InChIKey
YABBDMCUYMMXBK-UHFFFAOYSA-N
Compound name
[4-(dimethylamino)-3,5-dimethylphenyl] N-(2-oxopropyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.1474 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.15468 161.5
[M+Na]+ 287.13662 168.1
[M-H]- 263.14012 166.9
[M+NH4]+ 282.18122 178.8
[M+K]+ 303.11056 167.9
[M+H-H2O]+ 247.14466 154.5
[M+HCOO]- 309.14560 186.1
[M+CH3COO]- 323.16125 208.2
[M+Na-2H]- 285.12207 162.4
[M]+ 264.14685 165.7
[M]- 264.14795 165.7
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.