CID 155819876

2470439-06-4

Structural Information

Molecular Formula
C9H17NO
SMILES
CCC12CCC(CC1)(CO2)N
InChI
InChI=1S/C9H17NO/c1-2-9-5-3-8(10,4-6-9)7-11-9/h2-7,10H2,1H3
InChIKey
VOGORIWKHCMEMM-UHFFFAOYSA-N
Compound name
1-ethyl-2-oxabicyclo[2.2.2]octan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.13101 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.138286 134.3
[M+Na]+ 178.120228 139.2
[M-H]- 154.123734 131.4
[M+NH4]+ 173.164833 161.7
[M+K]+ 194.094168 138.2
[M+H-H2O]+ 138.128270 129.6
[M+HCOO]- 200.129211 145.9
[M+CH3COO]- 214.144861 145.5
[M+Na-2H]- 176.105676 148.0
[M]+ 155.13046142 134.1
[M]- 155.13155858 134.1
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

No patent data available for this compound.