CID 21541751

3,3-diethylcyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula

C₈H₁₇N

SMILES

CCC1(CC(C1)N)CC

InChI

InChI=1S/C8H17N/c1-3-8(4-2)5-7(9)6-8/h7H,3-6,9H2,1-2H3

InChIKey

PVNNMRCNQWVMER-UHFFFAOYSA-N

Compound name

3,3-diethylcyclobutan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 127.1361 Da
Monoisotopic Mass: 2.1
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]+	128.14338	129.7
[M+Na]+	150.12532	135.5
[M+NH4]+	145.16992	136.2
[M+K]+	166.09926	129.7
[M-H]-	126.12882	129.3
[M+Na-2H]-	148.11077	133.6
[M]+	127.13555	129.3
[M]-	127.13665	129.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe