CID 9926715

147008-96-6

Structural Information

Molecular Formula

C₁₂H₁₃ClN₂

SMILES

C1CC2=C(CC1N)C3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C12H13ClN2/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1,3,5,8,15H,2,4,6,14H2

InChIKey

BODQGEOXSNZRGK-UHFFFAOYSA-N

Compound name

6-chloro-2,3,4,9-tetrahydro-1H-carbazol-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 220.07672 Da
Monoisotopic Mass: 2.5
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]+	221.08400	144.3
[M+Na]+	243.06594	158.4
[M+NH4]+	238.11054	154.8
[M+K]+	259.03988	151.9
[M-H]-	219.06944	147.8
[M+Na-2H]-	241.05139	150.1
[M]+	220.07617	147.6
[M]-	220.07727	147.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe