CID 10986289

1h-pyrrolo[3,2-c]pyridine, 4,5,6,7-tetrahydro-1-methyl-, hydrochloride (1:1)

Structural Information

Molecular Formula
C8H12N2
SMILES
CN1C=CC2=C1CCNC2
InChI
InChI=1S/C8H12N2/c1-10-5-3-7-6-9-4-2-8(7)10/h3,5,9H,2,4,6H2,1H3
InChIKey
JLMLWTWDUVBDER-UHFFFAOYSA-N
Compound name
1-methyl-4,5,6,7-tetrahydropyrrolo[3,2-c]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

136.10005 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.10733 128.6
[M+Na]+ 159.08927 136.4
[M-H]- 135.09277 128.8
[M+NH4]+ 154.13387 150.0
[M+K]+ 175.06321 133.5
[M+H-H2O]+ 119.09731 122.0
[M+HCOO]- 181.09825 147.2
[M+CH3COO]- 195.11390 141.4
[M+Na-2H]- 157.07472 134.6
[M]+ 136.09950 124.4
[M]- 136.10060 124.4
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