CID 28064327

959238-35-8

Structural Information

Molecular Formula
C8H17NO
SMILES
CNCCC1(CCCC1)O
InChI
InChI=1S/C8H17NO/c1-9-7-6-8(10)4-2-3-5-8/h9-10H,2-7H2,1H3
InChIKey
ULWCQTYWQPOPFV-UHFFFAOYSA-N
Compound name
1-[2-(methylamino)ethyl]cyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

143.13101 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.138286 132.5
[M+Na]+ 166.120228 137.7
[M-H]- 142.123734 134.2
[M+NH4]+ 161.164833 156.6
[M+K]+ 182.094168 136.4
[M+H-H2O]+ 126.128270 127.9
[M+HCOO]- 188.129211 154.9
[M+CH3COO]- 202.144861 172.9
[M+Na-2H]- 164.105676 138.0
[M]+ 143.13046142 128.9
[M]- 143.13155858 128.9
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

patents stripe