CID 6485437

55746-19-5

Structural Information

Molecular Formula

C₁₀H₁₃NO

SMILES

CC1CC2=C(O1)C=CC(=C2)CN

InChI

InChI=1S/C10H13NO/c1-7-4-9-5-8(6-11)2-3-10(9)12-7/h2-3,5,7H,4,6,11H2,1H3

InChIKey

HRICJDUBSORGIY-UHFFFAOYSA-N

Compound name

(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 163.09972 Da
Monoisotopic Mass: 1.2
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]+	164.10700	133.3
[M+Na]+	186.08894	145.2
[M+NH4]+	181.13354	143.0
[M+K]+	202.06288	140.7
[M-H]-	162.09244	137.7
[M+Na-2H]-	184.07439	138.4
[M]+	163.09917	136.2
[M]-	163.10027	136.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe