CID 131079409

2-cyclopentylbut-3-yn-2-amine hydrochloride

Structural Information

Molecular Formula
C9H15N
SMILES
CC(C#C)(C1CCCC1)N
InChI
InChI=1S/C9H15N/c1-3-9(2,10)8-6-4-5-7-8/h1,8H,4-7,10H2,2H3
InChIKey
NYMGRPPPBIIYBB-UHFFFAOYSA-N
Compound name
2-cyclopentylbut-3-yn-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

137.12045 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.12773 136.3
[M+Na]+ 160.10967 144.2
[M-H]- 136.11317 137.6
[M+NH4]+ 155.15427 156.6
[M+K]+ 176.08361 140.7
[M+H-H2O]+ 120.11771 125.2
[M+HCOO]- 182.11865 151.9
[M+CH3COO]- 196.13430 183.8
[M+Na-2H]- 158.09512 139.2
[M]+ 137.11990 126.3
[M]- 137.12100 126.3
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.