CID 65014589

1519765-68-4

Structural Information

Molecular Formula

C₉H₁₉N

SMILES

CC(C)(C)C1CC(C1)CN

InChI

InChI=1S/C9H19N/c1-9(2,3)8-4-7(5-8)6-10/h7-8H,4-6,10H2,1-3H3

InChIKey

WQWJQZWVFAJXQF-UHFFFAOYSA-N

Compound name

(3-tert-butylcyclobutyl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 141.15175 Da
Monoisotopic Mass: 2.0
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]+	142.15903	135.1
[M+Na]+	164.14097	140.0
[M-H]-	140.14447	138.1
[M+NH4]+	159.18557	150.2
[M+K]+	180.11491	142.0
[M+H-H2O]+	124.14901	125.3
[M+HCOO]-	186.14995	155.0
[M+CH3COO]-	200.16560	182.5
[M+Na-2H]-	162.12642	139.2
[M]+	141.15120	141.2
[M]-	141.15230	141.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe