CID 39235218

1820572-17-5

Structural Information

Molecular Formula

C₁₀H₁₃N

SMILES

CC1=CC=CC=C1[C@@H]2C[C@H]2N

InChI

InChI=1S/C10H13N/c1-7-4-2-3-5-8(7)9-6-10(9)11/h2-5,9-10H,6,11H2,1H3/t9-,10+/m0/s1

InChIKey

KZEFZXPGEZBFNW-VHSXEESVSA-N

Compound name

(1R,2S)-2-(2-methylphenyl)cyclopropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
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	130.8
[M+Na]+	170.09402	145.3
[M+NH4]+	165.13862	141.2
[M+K]+	186.06796	139.7
[M-H]-	146.09752	142.4
[M+Na-2H]-	168.07947	141.8
[M]+	147.10425	137.3
[M]-	147.10535	137.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe