CID 200582

Phenoxazine, 10-(3-(dimethylamino)propyl)-, phosphate

Structural Information

Molecular Formula

C₁₇H₂₀N₂O

SMILES

CN(C)CCCN1C2=CC=CC=C2OC3=CC=CC=C31

InChI

InChI=1S/C17H20N2O/c1-18(2)12-7-13-19-14-8-3-5-10-16(14)20-17-11-6-4-9-15(17)19/h3-6,8-11H,7,12-13H2,1-2H3

InChIKey

MRRZODWLDXCVIA-UHFFFAOYSA-N

Compound name

N,N-dimethyl-3-phenoxazin-10-ylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 268.15756 Da
Monoisotopic Mass: 4.0
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]+	269.164836	163.1
[M+Na]+	291.146778	170.0
[M-H]-	267.150284	168.5
[M+NH4]+	286.191383	179.3
[M+K]+	307.120718	167.5
[M+H-H2O]+	251.154820	154.2
[M+HCOO]-	313.155761	182.6
[M+CH3COO]-	327.171411	174.7
[M+Na-2H]-	289.132226	171.2
[M]+	268.15701142	165.5
[M]-	268.15810858	165.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe