CID 3061289

78959-28-1

Structural Information

Molecular Formula
C11H13N3O2
SMILES
CCC(=O)NNC1=NC2=CC=CC=C2OC1
InChI
InChI=1S/C11H13N3O2/c1-2-11(15)14-13-10-7-16-9-6-4-3-5-8(9)12-10/h3-6H,2,7H2,1H3,(H,12,13)(H,14,15)
InChIKey
ZLQKXLBEFMWHDU-UHFFFAOYSA-N
Compound name
N'-(2H-1,4-benzoxazin-3-yl)propanehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.10077 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.10805 147.3
[M+Na]+ 242.08999 153.8
[M-H]- 218.09349 151.0
[M+NH4]+ 237.13459 163.6
[M+K]+ 258.06393 152.5
[M+H-H2O]+ 202.09803 139.5
[M+HCOO]- 264.09897 169.2
[M+CH3COO]- 278.11462 191.0
[M+Na-2H]- 240.07544 156.5
[M]+ 219.10022 146.7
[M]- 219.10132 146.7
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.