CID 55286296

6-methyl-1,2,3,4-tetrahydro-1,5-naphthyridine

Structural Information

Molecular Formula
C9H12N2
SMILES
CC1=NC2=C(C=C1)NCCC2
InChI
InChI=1S/C9H12N2/c1-7-4-5-8-9(11-7)3-2-6-10-8/h4-5,10H,2-3,6H2,1H3
InChIKey
QHBVMXCFDIWSIQ-UHFFFAOYSA-N
Compound name
6-methyl-1,2,3,4-tetrahydro-1,5-naphthyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

148.10005 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.10733 131.1
[M+Na]+ 171.08927 138.5
[M-H]- 147.09277 131.0
[M+NH4]+ 166.13387 150.1
[M+K]+ 187.06321 135.0
[M+H-H2O]+ 131.09731 124.0
[M+HCOO]- 193.09825 148.5
[M+CH3COO]- 207.11390 143.3
[M+Na-2H]- 169.07472 139.4
[M]+ 148.09950 126.4
[M]- 148.10060 126.4
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

patents stripe