CID 3046824

5h-1-pyrindine, 6,7-dihydro-4-amino-2,3-dimethyl-, hydrate

Structural Information

Molecular Formula
C10H14N2
SMILES
CC1=C(N=C2CCCC2=C1N)C
InChI
InChI=1S/C10H14N2/c1-6-7(2)12-9-5-3-4-8(9)10(6)11/h3-5H2,1-2H3,(H2,11,12)
InChIKey
XCACCLNWIIMXHQ-UHFFFAOYSA-N
Compound name
2,3-dimethyl-6,7-dihydro-5H-cyclopenta[b]pyridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

162.11569 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.12297 134.6
[M+Na]+ 185.10491 144.0
[M-H]- 161.10841 137.9
[M+NH4]+ 180.14951 157.2
[M+K]+ 201.07885 140.9
[M+H-H2O]+ 145.11295 128.7
[M+HCOO]- 207.11389 157.2
[M+CH3COO]- 221.12954 182.2
[M+Na-2H]- 183.09036 139.2
[M]+ 162.11514 133.0
[M]- 162.11624 133.0
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