CID 3077572

Hydrazinecarboxamide, 2-(2-(diethylamino)-6,7-dimethoxy-4-quinazolinyl)-n-methyl-, hydrate

Structural Information

Molecular Formula
C16H24N6O3
SMILES
CCN(CC)C1=NC2=CC(=C(C=C2C(=N1)NNC(=O)NC)OC)OC
InChI
InChI=1S/C16H24N6O3/c1-6-22(7-2)15-18-11-9-13(25-5)12(24-4)8-10(11)14(19-15)20-21-16(23)17-3/h8-9H,6-7H2,1-5H3,(H2,17,21,23)(H,18,19,20)
InChIKey
HFPAINUPIKHKDI-UHFFFAOYSA-N
Compound name
1-[[2-(diethylamino)-6,7-dimethoxyquinazolin-4-yl]amino]-3-methylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

348.19098 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.19826 182.4
[M+Na]+ 371.18020 188.1
[M-H]- 347.18370 185.9
[M+NH4]+ 366.22480 193.8
[M+K]+ 387.15414 187.0
[M+H-H2O]+ 331.18824 172.4
[M+HCOO]- 393.18918 206.1
[M+CH3COO]- 407.20483 228.9
[M+Na-2H]- 369.16565 187.6
[M]+ 348.19043 187.2
[M]- 348.19153 187.2
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.