CID 3077463

Brn 4820312

Structural Information

Molecular Formula
C17H20N4O3
SMILES
CC1=NC2=CC=CC=C2C=C1C(=O)NNC(=O)CN3CCOCC3
InChI
InChI=1S/C17H20N4O3/c1-12-14(10-13-4-2-3-5-15(13)18-12)17(23)20-19-16(22)11-21-6-8-24-9-7-21/h2-5,10H,6-9,11H2,1H3,(H,19,22)(H,20,23)
InChIKey
FWLVZVVHTUQXRT-UHFFFAOYSA-N
Compound name
2-methyl-N'-(2-morpholin-4-ylacetyl)quinoline-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

328.15353 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.16081 177.0
[M+Na]+ 351.14275 180.7
[M-H]- 327.14625 181.4
[M+NH4]+ 346.18735 186.6
[M+K]+ 367.11669 178.2
[M+H-H2O]+ 311.15079 166.5
[M+HCOO]- 373.15173 193.2
[M+CH3COO]- 387.16738 212.3
[M+Na-2H]- 349.12820 181.8
[M]+ 328.15298 174.0
[M]- 328.15408 174.0
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.