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]+ 124.11208 123.7
[M+Na]+ 146.09402 131.3
[M-H]- 122.09752 126.5
[M+NH4]+ 141.13862 139.4
[M+K]+ 162.06796 132.4
[M+H-H2O]+ 106.10206 109.7
[M+HCOO]- 168.10300 141.0
[M+CH3COO]- 182.11865 186.0
[M+Na-2H]- 144.07947 130.3
[M]+ 123.10425 124.8
[M]- 123.10535 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.