CID 145912980

2378502-25-9

Structural Information

Molecular Formula

C₈H₁₃N

SMILES

C1CC1=C2CC(C2)CN

InChI

InChI=1S/C8H13N/c9-5-6-3-8(4-6)7-1-2-7/h6H,1-5,9H2

InChIKey

SSXNVXOYBWENHZ-UHFFFAOYSA-N

Compound name

(3-cyclopropylidenecyclobutyl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 123.1048 Da
Monoisotopic Mass: 0.1
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]+	124.11208	122.1
[M+Na]+	146.09402	129.3
[M-H]-	122.09752	129.2
[M+NH4]+	141.13862	133.2
[M+K]+	162.06796	129.6
[M+H-H2O]+	106.10206	111.4
[M+HCOO]-	168.10300	144.6
[M+CH3COO]-	182.11865	180.4
[M+Na-2H]-	144.07947	127.4
[M]+	123.10425	128.7
[M]-	123.10535	128.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.