CID 3069635

84966-94-9

Structural Information

Molecular Formula
C14H18N4O4
SMILES
CC(=O)NC1=CC=CC=C1C(=O)C(=O)NNC(=O)CN(C)C
InChI
InChI=1S/C14H18N4O4/c1-9(19)15-11-7-5-4-6-10(11)13(21)14(22)17-16-12(20)8-18(2)3/h4-7H,8H2,1-3H3,(H,15,19)(H,16,20)(H,17,22)
InChIKey
GFAHXOGHHLIDQP-UHFFFAOYSA-N
Compound name
N-[2-[2-[2-[2-(dimethylamino)acetyl]hydrazinyl]-2-oxoacetyl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.1328 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.14008 171.5
[M+Na]+ 329.12202 174.3
[M-H]- 305.12552 176.2
[M+NH4]+ 324.16662 185.2
[M+K]+ 345.09596 175.0
[M+H-H2O]+ 289.13006 163.0
[M+HCOO]- 351.13100 196.6
[M+CH3COO]- 365.14665 217.4
[M+Na-2H]- 327.10747 172.1
[M]+ 306.13225 171.8
[M]- 306.13335 171.8
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.