CID 104077

N-(1,1-dimethyl-2-phenylethyl)formamide

Structural Information

Molecular Formula

C₁₁H₁₅NO

SMILES

CC(C)(CC1=CC=CC=C1)NC=O

InChI

InChI=1S/C11H15NO/c1-11(2,12-9-13)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,12,13)

InChIKey

VDURGCJDOKTFHJ-UHFFFAOYSA-N

Compound name

N-(2-methyl-1-phenylpropan-2-yl)formamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 44
Patents: 177.11537 Da
Monoisotopic Mass: 2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	178.122646	139.3
[M+Na]+	200.104588	145.7
[M-H]-	176.108094	142.7
[M+NH4]+	195.149193	159.2
[M+K]+	216.078528	143.6
[M+H-H2O]+	160.112630	133.5
[M+HCOO]-	222.113571	163.1
[M+CH3COO]-	236.129221	183.7
[M+Na-2H]-	198.090036	147.4
[M]+	177.11482142	139.4
[M]-	177.11591858	139.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe