CID 165778521

N-ethyl-1-ethynylcyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula
C8H13N
SMILES
CCNC1(CCC1)C#C
InChI
InChI=1S/C8H13N/c1-3-8(9-4-2)6-5-7-8/h1,9H,4-7H2,2H3
InChIKey
ASULSZREJHMPSK-UHFFFAOYSA-N
Compound name
N-ethyl-1-ethynylcyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

123.1048 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.112076 123.7
[M+Na]+ 146.094018 131.3
[M-H]- 122.097524 126.5
[M+NH4]+ 141.138623 139.4
[M+K]+ 162.067958 132.4
[M+H-H2O]+ 106.102060 109.7
[M+HCOO]- 168.103001 141.0
[M+CH3COO]- 182.118651 186.0
[M+Na-2H]- 144.079466 130.3
[M]+ 123.10425142 124.8
[M]- 123.10534858 124.8
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

No patent data available for this compound.