CID 18802016

4-chloro-6-(propan-2-yl)quinazoline

Structural Information

Molecular Formula
C11H11ClN2
SMILES
CC(C)C1=CC2=C(C=C1)N=CN=C2Cl
InChI
InChI=1S/C11H11ClN2/c1-7(2)8-3-4-10-9(5-8)11(12)14-6-13-10/h3-7H,1-2H3
InChIKey
SZIVOSQYCAPLTH-UHFFFAOYSA-N
Compound name
4-chloro-6-propan-2-ylquinazoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.06108 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.06836 142.2
[M+Na]+ 229.05030 158.7
[M+NH4]+ 224.09490 152.0
[M+K]+ 245.02424 150.3
[M-H]- 205.05380 145.0
[M+Na-2H]- 227.03575 150.5
[M]+ 206.06053 145.8
[M]- 206.06163 145.8
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.

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No patent data available for this compound.