CID 28063235

(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methanamine

Structural Information

Molecular Formula
C10H15N3
SMILES
CC1=C2CCCCC2=NC(=N1)CN
InChI
InChI=1S/C10H15N3/c1-7-8-4-2-3-5-9(8)13-10(6-11)12-7/h2-6,11H2,1H3
InChIKey
MDBOUHXUPNVKKN-UHFFFAOYSA-N
Compound name
(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.1266 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.13388 139.6
[M+Na]+ 200.11582 147.1
[M-H]- 176.11932 140.6
[M+NH4]+ 195.16042 157.8
[M+K]+ 216.08976 143.8
[M+H-H2O]+ 160.12386 131.9
[M+HCOO]- 222.12480 158.6
[M+CH3COO]- 236.14045 184.2
[M+Na-2H]- 198.10127 146.4
[M]+ 177.12605 135.8
[M]- 177.12715 135.8
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.