CID 79420807

3-amino-2-cyclopentylpropan-1-ol

Structural Information

Molecular Formula
C8H17NO
SMILES
C1CCC(C1)C(CN)CO
InChI
InChI=1S/C8H17NO/c9-5-8(6-10)7-3-1-2-4-7/h7-8,10H,1-6,9H2
InChIKey
ZATZEOUVAFBJPN-UHFFFAOYSA-N
Compound name
3-amino-2-cyclopentylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

143.13101 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 134.6
[M+Na]+ 166.12023 138.6
[M-H]- 142.12373 135.5
[M+NH4]+ 161.16483 156.3
[M+K]+ 182.09417 137.2
[M+H-H2O]+ 126.12827 129.1
[M+HCOO]- 188.12921 155.3
[M+CH3COO]- 202.14486 173.5
[M+Na-2H]- 164.10568 136.5
[M]+ 143.13046 128.9
[M]- 143.13156 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

No patent data available for this compound.