CID 12397494

18096-45-2

Structural Information

Molecular Formula
C11H17N3
SMILES
C1CCC2(CC1)C3=C(CCN2)NC=N3
InChI
InChI=1S/C11H17N3/c1-2-5-11(6-3-1)10-9(4-7-14-11)12-8-13-10/h8,14H,1-7H2,(H,12,13)
InChIKey
XKIAHMSAUTZOBQ-UHFFFAOYSA-N
Compound name
spiro[1,5,6,7-tetrahydroimidazo[4,5-c]pyridine-4,1'-cyclohexane]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.14224 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.14952 145.7
[M+Na]+ 214.13146 150.8
[M-H]- 190.13496 144.3
[M+NH4]+ 209.17606 164.3
[M+K]+ 230.10540 145.8
[M+H-H2O]+ 174.13950 137.0
[M+HCOO]- 236.14044 157.5
[M+CH3COO]- 250.15609 155.2
[M+Na-2H]- 212.11691 150.7
[M]+ 191.14169 135.0
[M]- 191.14279 135.0
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

No patent data available for this compound.