CID 97170

6-butyl-8-oxa-6-azabicyclo[3.2.1]octane

Structural Information

Molecular Formula
C10H19NO
SMILES
CCCCN1CC2CCCC1O2
InChI
InChI=1S/C10H19NO/c1-2-3-7-11-8-9-5-4-6-10(11)12-9/h9-10H,2-8H2,1H3
InChIKey
WJWITLCTPIHCFZ-UHFFFAOYSA-N
Compound name
6-butyl-8-oxa-6-azabicyclo[3.2.1]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.14667 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.15395 139.3
[M+Na]+ 192.13589 144.9
[M-H]- 168.13939 140.4
[M+NH4]+ 187.18049 160.6
[M+K]+ 208.10983 144.2
[M+H-H2O]+ 152.14393 133.5
[M+HCOO]- 214.14487 156.1
[M+CH3COO]- 228.16052 180.2
[M+Na-2H]- 190.12134 144.6
[M]+ 169.14612 138.1
[M]- 169.14722 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

No patent data available for this compound.