CID 14589042

Dtxsid501377302

Structural Information

Molecular Formula
C15H24N2O2
SMILES
C1CCN2C[C@@H]3C[C@H]([C@@H]2C1)CN4[C@@H]3CC[C@@H](C4=O)O
InChI
InChI=1S/C15H24N2O2/c18-14-5-4-13-10-7-11(9-17(13)15(14)19)12-3-1-2-6-16(12)8-10/h10-14,18H,1-9H2/t10-,11-,12-,13+,14-/m0/s1
InChIKey
FROKOSJUHZENQC-YHQUGGNUSA-N
Compound name
(1S,2R,5S,9S,10S)-5-hydroxy-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-6-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

264.18378 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.19106 162.1
[M+Na]+ 287.17300 165.1
[M-H]- 263.17650 160.1
[M+NH4]+ 282.21760 178.2
[M+K]+ 303.14694 160.4
[M+H-H2O]+ 247.18104 153.4
[M+HCOO]- 309.18198 166.6
[M+CH3COO]- 323.19763 169.3
[M+Na-2H]- 285.15845 164.5
[M]+ 264.18323 151.9
[M]- 264.18433 151.9
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.