CID 102254333

2470279-62-8

Structural Information

Molecular Formula
C10H17NO2
SMILES
COC(=O)[C@@H]1CC/C=C\CC[C@@H]1N
InChI
InChI=1S/C10H17NO2/c1-13-10(12)8-6-4-2-3-5-7-9(8)11/h2-3,8-9H,4-7,11H2,1H3/b3-2-/t8-,9+/m1/s1
InChIKey
XJDIJSXVYYEKKN-HVSMVGKISA-N
Compound name
methyl (1R,4Z,8S)-8-aminocyclooct-4-ene-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

183.12593 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.13321 142.8
[M+Na]+ 206.11515 145.9
[M+NH4]+ 201.15975 145.4
[M+K]+ 222.08909 145.7
[M-H]- 182.11865 143.5
[M+Na-2H]- 204.10060 145.7
[M]+ 183.12538 143.3
[M]- 183.12648 143.3
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

patents stripe