CID 53276254

2-methoxy-2-phenylpropan-1-amine

Structural Information

Molecular Formula

C₁₀H₁₅NO

SMILES

CC(CN)(C1=CC=CC=C1)OC

InChI

InChI=1S/C10H15NO/c1-10(8-11,12-2)9-6-4-3-5-7-9/h3-7H,8,11H2,1-2H3

InChIKey

QQTDPACYVQKADZ-UHFFFAOYSA-N

Compound name

2-methoxy-2-phenylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 165.11537 Da
Monoisotopic Mass: 0.9
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]+	166.122646	136.4
[M+Na]+	188.104588	143.0
[M-H]-	164.108094	139.6
[M+NH4]+	183.149193	156.7
[M+K]+	204.078528	141.4
[M+H-H2O]+	148.112630	130.9
[M+HCOO]-	210.113571	159.8
[M+CH3COO]-	224.129221	180.8
[M+Na-2H]-	186.090036	144.0
[M]+	165.11482142	135.9
[M]-	165.11591858	135.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe