CID 3073381

Matridin-15-one, 13-hydroxy-, (13-alpha)-

Structural Information

Molecular Formula
C15H24N2O2
SMILES
C1CC2CN3C(CC(CC3=O)O)C4C2N(C1)CCC4
InChI
InChI=1S/C15H24N2O2/c18-11-7-13-12-4-2-6-16-5-1-3-10(15(12)16)9-17(13)14(19)8-11/h10-13,15,18H,1-9H2
InChIKey
YYLKMMPLIIOMLQ-UHFFFAOYSA-N
Compound name
4-hydroxy-7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

264.18378 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.191056 163.2
[M+Na]+ 287.172998 165.9
[M-H]- 263.176504 161.9
[M+NH4]+ 282.217603 179.0
[M+K]+ 303.146938 161.3
[M+H-H2O]+ 247.181040 154.2
[M+HCOO]- 309.181981 168.0
[M+CH3COO]- 323.197631 170.4
[M+Na-2H]- 285.158446 165.1
[M]+ 264.18323142 152.9
[M]- 264.18432858 152.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe