CID 24777767

808756-83-4

Structural Information

Molecular Formula

C₁₃H₁₉N

SMILES

CC(C)(C)C1=CC2=C(C=C1)[C@@H](CC2)N

InChI

InChI=1S/C13H19N/c1-13(2,3)10-5-6-11-9(8-10)4-7-12(11)14/h5-6,8,12H,4,7,14H2,1-3H3/t12-/m1/s1

InChIKey

JYRVCRJPCWMDQT-GFCCVEGCSA-N

Compound name

(1R)-5-tert-butyl-2,3-dihydro-1H-inden-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 52
Patents: 189.15175 Da
Monoisotopic Mass: 2.9
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]+	190.15903	143.7
[M+Na]+	212.14097	154.9
[M+NH4]+	207.18557	153.5
[M+K]+	228.11491	150.1
[M-H]-	188.14447	146.7
[M+Na-2H]-	210.12642	149.0
[M]+	189.15120	146.2
[M]-	189.15230	146.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe