CID 3281515

Cyclopropyl(phenyl)methanamine

Structural Information

Molecular Formula

C₁₀H₁₃N

SMILES

C1CC1C(C2=CC=CC=C2)N

InChI

InChI=1S/C10H13N/c11-10(9-6-7-9)8-4-2-1-3-5-8/h1-5,9-10H,6-7,11H2

InChIKey

UCRSQPUGEDLYSH-UHFFFAOYSA-N

Compound name

cyclopropyl(phenyl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 371
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	127.3
[M+Na]+	170.09402	135.2
[M-H]-	146.09752	134.4
[M+NH4]+	165.13862	143.2
[M+K]+	186.06796	132.4
[M+H-H2O]+	130.10206	120.8
[M+HCOO]-	192.10300	151.7
[M+CH3COO]-	206.11865	181.3
[M+Na-2H]-	168.07947	134.0
[M]+	147.10425	126.5
[M]-	147.10535	126.5

Literature stripe

literature stripe

Patent stripe

patents stripe