CID 14603

N-ethoxycarbonylmethylcamphidine hydrochloride

Structural Information

Molecular Formula
C14H25NO2
SMILES
CCOC(=O)CN1CC2CCC(C1)(C2(C)C)C
InChI
InChI=1S/C14H25NO2/c1-5-17-12(16)9-15-8-11-6-7-14(4,10-15)13(11,2)3/h11H,5-10H2,1-4H3
InChIKey
AVHGZLFUDDJRFM-UHFFFAOYSA-N
Compound name
ethyl 2-(1,8,8-trimethyl-3-azabicyclo[3.2.1]octan-3-yl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.18852 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.19580 158.0
[M+Na]+ 262.17774 164.7
[M-H]- 238.18124 159.0
[M+NH4]+ 257.22234 182.0
[M+K]+ 278.15168 162.7
[M+H-H2O]+ 222.18578 153.2
[M+HCOO]- 284.18672 173.7
[M+CH3COO]- 298.20237 194.0
[M+Na-2H]- 260.16319 161.0
[M]+ 239.18797 158.8
[M]- 239.18907 158.8
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.