CID 62759023

N-[(1,3-thiazol-5-yl)methyl]cyclopentanamine hydrochloride

Structural Information

Molecular Formula
C9H14N2S
SMILES
C1CCC(C1)NCC2=CN=CS2
InChI
InChI=1S/C9H14N2S/c1-2-4-8(3-1)11-6-9-5-10-7-12-9/h5,7-8,11H,1-4,6H2
InChIKey
YSAOXKMHLHLENR-UHFFFAOYSA-N
Compound name
N-(1,3-thiazol-5-ylmethyl)cyclopentanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.08777 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.095046 139.2
[M+Na]+ 205.076988 145.9
[M-H]- 181.080494 144.7
[M+NH4]+ 200.121593 161.5
[M+K]+ 221.050928 143.8
[M+H-H2O]+ 165.085030 132.5
[M+HCOO]- 227.085971 158.8
[M+CH3COO]- 241.101621 152.3
[M+Na-2H]- 203.062436 140.1
[M]+ 182.08722142 137.8
[M]- 182.08831858 137.8
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.