CID 54325819

2204958-97-2

Structural Information

Molecular Formula

C₆H₁₁N

SMILES

C=CCC1(CC1)N

InChI

InChI=1S/C6H11N/c1-2-3-6(7)4-5-6/h2H,1,3-5,7H2

InChIKey

NQOWTWQEWYVXFY-UHFFFAOYSA-N

Compound name

1-prop-2-enylcyclopropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 15
Patents: 97.08915 Da
Monoisotopic Mass: 0.8
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]+	98.096426	119.0
[M+Na]+	120.07837	128.4
[M-H]-	96.081874	123.7
[M+NH4]+	115.12297	138.9
[M+K]+	136.05231	126.8
[M+H-H2O]+	80.086410	114.7
[M+HCOO]-	142.08735	143.5
[M+CH3COO]-	156.10300	172.1
[M+Na-2H]-	118.06382	127.1
[M]+	97.088601	119.5
[M]-	97.089699	119.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe