CID 67659013

En300-45184493

Structural Information

Molecular Formula
C8H17NO
SMILES
C1CCC[C@@H]([C@@H](CC1)N)O
InChI
InChI=1S/C8H17NO/c9-7-5-3-1-2-4-6-8(7)10/h7-8,10H,1-6,9H2/t7-,8+/m1/s1
InChIKey
DUJAFYDYPPBLOY-SFYZADRCSA-N
Compound name
cis-(1S,2R)-2-aminocyclooctan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

143.13101 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.138286 141.4
[M+Na]+ 166.120228 145.3
[M-H]- 142.123734 142.3
[M+NH4]+ 161.164833 150.6
[M+K]+ 182.094168 145.7
[M+H-H2O]+ 126.128270 138.2
[M+HCOO]- 188.129211 150.2
[M+CH3COO]- 202.144861 218.2
[M+Na-2H]- 164.105676 141.6
[M]+ 143.13046142 138.1
[M]- 143.13155858 138.1
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