CID 44617

63716-33-6

Structural Information

Molecular Formula

C₁₄H₁₈N₂

SMILES

CCN1C2=C(CCCC2)C3=C1C=CC(=C3)N

InChI

InChI=1S/C14H18N2/c1-2-16-13-6-4-3-5-11(13)12-9-10(15)7-8-14(12)16/h7-9H,2-6,15H2,1H3

InChIKey

OWFDXPHKJHNJNF-UHFFFAOYSA-N

Compound name

9-ethyl-5,6,7,8-tetrahydrocarbazol-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 214.147 Da
Monoisotopic Mass: 2.8
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]+	215.154276	147.7
[M+Na]+	237.136218	156.8
[M-H]-	213.139724	151.6
[M+NH4]+	232.180823	169.1
[M+K]+	253.110158	151.8
[M+H-H2O]+	197.144260	141.0
[M+HCOO]-	259.145201	168.8
[M+CH3COO]-	273.160851	160.6
[M+Na-2H]-	235.121666	153.1
[M]+	214.14645142	146.3
[M]-	214.14754858	146.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe