CID 264663

Nsc99842

Structural Information

Molecular Formula
C20H26N4O2
SMILES
C1CC(C(C2C1CN3CCC4=C(C3C2)NC5=CC=CC=C45)C(=O)NN)O
InChI
InChI=1S/C20H26N4O2/c21-23-20(26)18-14-9-16-19-13(12-3-1-2-4-15(12)22-19)7-8-24(16)10-11(14)5-6-17(18)25/h1-4,11,14,16-18,22,25H,5-10,21H2,(H,23,26)
InChIKey
ACXXOPXBWJSGGQ-UHFFFAOYSA-N
Compound name
18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

354.20557 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.21285 177.5
[M+Na]+ 377.19479 181.8
[M-H]- 353.19829 177.6
[M+NH4]+ 372.23939 191.1
[M+K]+ 393.16873 174.9
[M+H-H2O]+ 337.20283 169.3
[M+HCOO]- 399.20377 186.0
[M+CH3COO]- 413.21942 184.3
[M+Na-2H]- 375.18024 179.5
[M]+ 354.20502 168.8
[M]- 354.20612 168.8
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

No patent data available for this compound.