CID 143709604

1-(3-methylidenecyclobutyl)ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C7H13N
SMILES
CC(C1CC(=C)C1)N
InChI
InChI=1S/C7H13N/c1-5-3-7(4-5)6(2)8/h6-7H,1,3-4,8H2,2H3
InChIKey
HTWZGGBDRLWXIJ-UHFFFAOYSA-N
Compound name
1-(3-methylidenecyclobutyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

111.1048 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 112.11208 125.7
[M+Na]+ 134.09402 130.9
[M-H]- 110.09752 128.8
[M+NH4]+ 129.13862 141.5
[M+K]+ 150.06796 132.9
[M+H-H2O]+ 94.102060 115.6
[M+HCOO]- 156.10300 146.9
[M+CH3COO]- 170.11865 176.9
[M+Na-2H]- 132.07947 129.0
[M]+ 111.10425 130.3
[M]- 111.10535 130.3
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

No patent data available for this compound.