CID 28064572

[1-(2-methylpropyl)cyclobutyl]methanamine

Structural Information

Molecular Formula
C9H19N
SMILES
CC(C)CC1(CCC1)CN
InChI
InChI=1S/C9H19N/c1-8(2)6-9(7-10)4-3-5-9/h8H,3-7,10H2,1-2H3
InChIKey
ZHRQQVCBZULLAE-UHFFFAOYSA-N
Compound name
[1-(2-methylpropyl)cyclobutyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

141.15175 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.159026 137.4
[M+Na]+ 164.140968 141.5
[M-H]- 140.144474 140.2
[M+NH4]+ 159.185573 153.9
[M+K]+ 180.114908 143.5
[M+H-H2O]+ 124.149010 128.0
[M+HCOO]- 186.149951 157.8
[M+CH3COO]- 200.165601 182.2
[M+Na-2H]- 162.126416 141.3
[M]+ 141.15120142 143.3
[M]- 141.15229858 143.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe