CID 38987

41734-73-0

Structural Information

Molecular Formula

C₁₇H₁₉ClN₂

SMILES

CN(C)CCCN1C2=C(C=C(C=C2)Cl)C3=CC=CC=C31

InChI

InChI=1S/C17H19ClN2/c1-19(2)10-5-11-20-16-7-4-3-6-14(16)15-12-13(18)8-9-17(15)20/h3-4,6-9,12H,5,10-11H2,1-2H3

InChIKey

DIVSTQUAADNJAJ-UHFFFAOYSA-N

Compound name

3-(3-chlorocarbazol-9-yl)-N,N-dimethylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 286.1237 Da
Monoisotopic Mass: 4.3
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]+	287.130976	167.7
[M+Na]+	309.112918	178.2
[M-H]-	285.116424	173.3
[M+NH4]+	304.157523	187.8
[M+K]+	325.086858	172.0
[M+H-H2O]+	269.120960	160.4
[M+HCOO]-	331.121901	186.9
[M+CH3COO]-	345.137551	180.4
[M+Na-2H]-	307.098366	172.8
[M]+	286.12315142	174.4
[M]-	286.12424858	174.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe