CID 22742624

361389-84-6

Structural Information

Molecular Formula

C₁₀H₁₃N

SMILES

CC1=CC2=C(CCC2N)C=C1

InChI

InChI=1S/C10H13N/c1-7-2-3-8-4-5-10(11)9(8)6-7/h2-3,6,10H,4-5,11H2,1H3

InChIKey

FMQGLSSKBZCURE-UHFFFAOYSA-N

Compound name

6-methyl-2,3-dihydro-1H-inden-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 106
Patents: 147.1048 Da
Monoisotopic Mass: 1.6
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]+	148.11208	129.9
[M+Na]+	170.09402	138.4
[M-H]-	146.09752	134.3
[M+NH4]+	165.13862	154.1
[M+K]+	186.06796	135.3
[M+H-H2O]+	130.10206	124.9
[M+HCOO]-	192.10300	153.8
[M+CH3COO]-	206.11865	178.4
[M+Na-2H]-	168.07947	135.4
[M]+	147.10425	127.3
[M]-	147.10535	127.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe