Metabolite 3-hydroxylidocaine

Name

3-hydroxylidocaine

Description

Not Available

Structure

Similar Structures

Synonyms

Not Available

UNII

Not Available

CAS number

Not Available

Weight

Average: 250.3367
Monoisotopic: 250.168127958

Chemical Formula

C₁₄H₂₂N₂O₂

InChI Key

PMGUCIDDSCRAMY-UHFFFAOYSA-N

InChI

InChI=1S/C14H22N2O2/c1-5-16(6-2)9-13(18)15-14-10(3)7-8-12(17)11(14)4/h7-8,17H,5-6,9H2,1-4H3,(H,15,18)

IUPAC Name

2-(diethylamino)-N-(3-hydroxy-2,6-dimethylphenyl)acetamide

SMILES

CCN(CC)CC(=O)NC1=C(C)C=CC(O)=C1C

Reactions

Spectra

Spectrum	Spectrum Type	Splash Key
Predicted GC-MS Spectrum - GC-MS	Predicted GC-MS	splash10-000i-9610000000-7d9e7465a3e0b86f4e10
Predicted MS/MS Spectrum - 10V, Positive (Annotated)	Predicted LC-MS/MS	splash10-0udi-4090000000-24401012ac050f6b6d21
Predicted MS/MS Spectrum - 10V, Negative (Annotated)	Predicted LC-MS/MS	splash10-0002-0980000000-ef87b5cd2bfe17b1910a
Predicted MS/MS Spectrum - 20V, Positive (Annotated)	Predicted LC-MS/MS	splash10-009i-8900000000-64573d5a892bfbd2f56a
Predicted MS/MS Spectrum - 20V, Negative (Annotated)	Predicted LC-MS/MS	splash10-000i-2900000000-5642489fe29c20a13ded
Predicted MS/MS Spectrum - 40V, Positive (Annotated)	Predicted LC-MS/MS	splash10-0ab9-9200000000-4323a09fffbadd82469c
Predicted MS/MS Spectrum - 40V, Negative (Annotated)	Predicted LC-MS/MS	splash10-000f-9700000000-7be8296af98ff5f6e06f

Chromatographic Properties

Adduct	CCS Value (Å²)	Source type	Source
[M-H]-	167.1584848	predicted	DarkChem Lite v0.1.0
[M-H]-	167.0605848	predicted	DarkChem Lite v0.1.0
[M-H]-	160.7639	predicted	DeepCCS 1.0 (2019)
[M+H]+	168.0862848	predicted	DarkChem Lite v0.1.0
[M+H]+	167.9835848	predicted	DarkChem Lite v0.1.0
[M+H]+	163.12189	predicted	DeepCCS 1.0 (2019)
[M+Na]+	167.1203848	predicted	DarkChem Lite v0.1.0
[M+Na]+	167.1795848	predicted	DarkChem Lite v0.1.0
[M+Na]+	169.21504	predicted	DeepCCS 1.0 (2019)

External Links

Predicted Properties