CID 65014589

(3-tert-butylcyclobutyl)methanamine

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

6
Patents

141.15175 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.159026 135.1
[M+Na]+ 164.140968 140.0
[M-H]- 140.144474 138.1
[M+NH4]+ 159.185573 150.2
[M+K]+ 180.114908 142.0
[M+H-H2O]+ 124.149010 125.3
[M+HCOO]- 186.149951 155.0
[M+CH3COO]- 200.165601 182.5
[M+Na-2H]- 162.126416 139.2
[M]+ 141.15120142 141.2
[M]- 141.15229858 141.2
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