CID 55284647

1314978-48-7

Structural Information

Molecular Formula

C₇H₁₅N

SMILES

CC(C)C1(CCC1)N

InChI

InChI=1S/C7H15N/c1-6(2)7(8)4-3-5-7/h6H,3-5,8H2,1-2H3

InChIKey

PGQQYBBQCJFYBX-UHFFFAOYSA-N

Compound name

1-propan-2-ylcyclobutan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 30
Patents: 113.12045 Da
Monoisotopic Mass: 1.3
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]+	114.127726	128.1
[M+Na]+	136.109668	133.0
[M-H]-	112.113174	131.3
[M+NH4]+	131.154273	145.7
[M+K]+	152.083608	135.6
[M+H-H2O]+	96.117710	119.1
[M+HCOO]-	158.118651	149.2
[M+CH3COO]-	172.134301	176.3
[M+Na-2H]-	134.095116	133.1
[M]+	113.11990142	133.3
[M]-	113.12099858	133.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe