CID 63822

4(3h)-quinazolinone, 3-(morpholinomethyl)-, hydrochloride

Structural Information

Molecular Formula
C13H15N3O2
SMILES
C1COCCN1CN2C=NC3=CC=CC=C3C2=O
InChI
InChI=1S/C13H15N3O2/c17-13-11-3-1-2-4-12(11)14-9-16(13)10-15-5-7-18-8-6-15/h1-4,9H,5-8,10H2
InChIKey
RQWHVRGWJQHJQT-UHFFFAOYSA-N
Compound name
3-(morpholin-4-ylmethyl)quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

245.11642 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.12370 155.3
[M+Na]+ 268.10564 170.3
[M+NH4]+ 263.15024 163.2
[M+K]+ 284.07958 163.1
[M-H]- 244.10914 159.7
[M+Na-2H]- 266.09109 162.5
[M]+ 245.11587 158.7
[M]- 245.11697 158.7
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.