CID 5315179

Venoterpine

Structural Information

Molecular Formula
C9H11NO
SMILES
CC1C(CC2=C1C=NC=C2)O
InChI
InChI=1S/C9H11NO/c1-6-8-5-10-3-2-7(8)4-9(6)11/h2-3,5-6,9,11H,4H2,1H3
InChIKey
IOIGOIPHPUCFOB-UHFFFAOYSA-N
Compound name
7-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

149.08406 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.091336 129.5
[M+Na]+ 172.073278 138.8
[M-H]- 148.076784 131.8
[M+NH4]+ 167.117883 152.1
[M+K]+ 188.047218 136.0
[M+H-H2O]+ 132.081320 124.1
[M+HCOO]- 194.082261 150.8
[M+CH3COO]- 208.097911 173.3
[M+Na-2H]- 170.058726 135.5
[M]+ 149.08351142 128.4
[M]- 149.08460858 128.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe