CID 2818489

153139-56-1

Structural Information

Molecular Formula

C₁₆H₂₀N₂O

SMILES

CN1C2=C(C3=CC=CC=C31)C(=O)C(CC2)CN(C)C

InChI

InChI=1S/C16H20N2O/c1-17(2)10-11-8-9-14-15(16(11)19)12-6-4-5-7-13(12)18(14)3/h4-7,11H,8-10H2,1-3H3

InChIKey

BSGMMRNLRWFVHL-UHFFFAOYSA-N

Compound name

3-[(dimethylamino)methyl]-9-methyl-2,3-dihydro-1H-carbazol-4-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 92
Patents: 256.15756 Da
Monoisotopic Mass: 2.2
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]+	257.16484	159.2
[M+Na]+	279.14678	168.4
[M-H]-	255.15028	165.0
[M+NH4]+	274.19138	179.8
[M+K]+	295.12072	164.6
[M+H-H2O]+	239.15482	152.0
[M+HCOO]-	301.15576	180.9
[M+CH3COO]-	315.17141	204.5
[M+Na-2H]-	277.13223	163.0
[M]+	256.15701	161.7
[M]-	256.15811	161.7

Literature stripe

literature stripe

Patent stripe

patents stripe