CID 54595342

2247101-95-5

Structural Information

Molecular Formula

C₁₁H₁₅N

SMILES

CC1(CCC2=CC=CC=C2C1)N

InChI

InChI=1S/C11H15N/c1-11(12)7-6-9-4-2-3-5-10(9)8-11/h2-5H,6-8,12H2,1H3

InChIKey

ALZSBYWRGWYZLS-UHFFFAOYSA-N

Compound name

2-methyl-3,4-dihydro-1H-naphthalen-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 161.12045 Da
Monoisotopic Mass: 1.9
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]+	162.12773	134.4
[M+Na]+	184.10967	141.5
[M-H]-	160.11317	138.3
[M+NH4]+	179.15427	157.8
[M+K]+	200.08361	138.5
[M+H-H2O]+	144.11771	129.0
[M+HCOO]-	206.11865	155.8
[M+CH3COO]-	220.13430	147.6
[M+Na-2H]-	182.09512	142.4
[M]+	161.11990	129.9
[M]-	161.12100	129.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe