CID 145867568

2375271-27-3

Structural Information

Molecular Formula
C14H23NO2
SMILES
CC(C)(C)OC(=O)N1C2CCCC1CC(=C)C2
InChI
InChI=1S/C14H23NO2/c1-10-8-11-6-5-7-12(9-10)15(11)13(16)17-14(2,3)4/h11-12H,1,5-9H2,2-4H3
InChIKey
YFSIHEHHDRWNBL-UHFFFAOYSA-N
Compound name
tert-butyl 3-methylidene-9-azabicyclo[3.3.1]nonane-9-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.17288 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.18016 158.0
[M+Na]+ 260.16210 162.6
[M-H]- 236.16560 158.3
[M+NH4]+ 255.20670 176.3
[M+K]+ 276.13604 160.4
[M+H-H2O]+ 220.17014 152.2
[M+HCOO]- 282.17108 170.1
[M+CH3COO]- 296.18673 193.4
[M+Na-2H]- 258.14755 161.1
[M]+ 237.17233 154.7
[M]- 237.17343 154.7
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.