CID 23180

6721-66-0

Structural Information

Molecular Formula

C₁₁H₁₇NO

SMILES

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

InChI

InChI=1S/C11H17NO/c1-12(2)9-11(13-3)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3

InChIKey

OEZZFHANQAGLDU-UHFFFAOYSA-N

Compound name

2-methoxy-N,N-dimethyl-2-phenylethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 179.13101 Da
Monoisotopic Mass: 1.6
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]+	180.13829	141.1
[M+Na]+	202.12023	146.6
[M-H]-	178.12373	145.8
[M+NH4]+	197.16483	161.4
[M+K]+	218.09417	146.6
[M+H-H2O]+	162.12827	134.5
[M+HCOO]-	224.12921	165.7
[M+CH3COO]-	238.14486	188.6
[M+Na-2H]-	200.10568	146.5
[M]+	179.13046	143.0
[M]-	179.13156	143.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe